2025年
284. X. H. Zhang, H. L. Zhang, Z. X. Chen, X. D. Chen, J. Y. Wang, S. X. Wei, S. Y. Liu*, Z. J. Wang*, F. N. Dai, M. H. Wang, X. Q. Lu*. Self-adapting oxyanion armor achieves highly stable and efficient seawater electrolysis at ampere-level current densities. Advanced Functional Materials, 2025, accepted.
283. X. H. Zhang#, Z. J. Wang#, S. F. Cao, X. J. Lin, X. D. Chen, Q. Hou, S. X. Wei, S. Y. Liu, F. N. Dai, D. F. Sun, X. Q. Lu*. Breaking the scaling relationship for high-performance seawater oxidation through lattice distortion triggered by molybdenum. Journal of Materials Science & Technology, 2025, accepted.
282. Z. J. Wang, Q. L. Liu, X. L. Sun, C. F. Xia, Q. K. Yin, M. H. Wang, X. D. Chen, H. L. Zhang, S. X. Wei, X. Q. Lu*, S. Y. Liu*. Post-modification of UiO-66-NH2 enhances the interfacial interaction of mixed matrix membranes for Efficient CO2/N2 separation. ACS Applied Polymer Materials, 2025, accepted.
281. H. X. Fang, X. K. Yue, L. Wang, S. Liu, H. L. Zhang, F. Feng, X. Gao, Z. J. Wang, S. X. Wei, X. Q. Lu*, S. Y. Liu, W. F. Lyu*. Molecular dynamics simulation of the effect of shale wettability on CO2 enhanced oil recovery. Langmuir, 2025, accepted.
280. S. Liu, M. H. Wang, L. Wang, S. X. Wei*, H. X. Fang, X. K.Yue, S. Y. Liu, Z. J. Wang, W. F. Lyu,* X. Q. Lu*. Effect of oore chemistry regulations on CO2 capture efficiency: charge transfer between anchored first-row transition open metal sites and frameworks. Separation and Purification Technology, 2025, 358, 130099.
279. C. F. Xia, Q. K. Yin, X. L. Sun, Q. L. Liu, S. Y. Liu, S. X. Wei, S. Y. Liu, W. F. Lv*, Z. J. Wang*, X. Q. Lu*. Tartaric acid anion intercalated layered double hydroxides constructed a CO2-favorable transport channel in Pim-1 mixed matrix membranes for CO2/N2 separation. Journal of Membrane Science, 2025, 713, 123381.
278. H. L. Zhang#, Z. J. Wang#, S. Liu, W. C. Li, S. X. Wei*, M. H. Wang, L. Zhang, W. F. Lyu*, S. Y. Liu, X. Q. Lu*. Ultrahigh CO2 capture and separation in 3d cage-COFs: synergistic effect from Li, topology, and pore size. Separation and Purification Technology, 2025, 356, 129897.
277. H. L. Zhang#, Z. J. Wang#, W. C. Li, L. Zhang, L. Wan, M. H. Wang*, S. Liu, S. X. Wei, X. Q. Lu*. Coordination environment regulated Li-COFs for efficient CO2 capture and separation over N2 and CH4. Applied Surface Science, 2025, 680, 161368.
2024年
276. L. Wang, S. Liu, Z. M. Ji, J. H. Wang, Y. Y. Shi, W. F. Lv*, X. Q. Lu*. Efficient CO2 capture over N2 in flexible MOFs: pressure driven breathing effect. Chemical Engineering Science, 2024, 299, 120562.
275. J. Xu*, J. B. Jiang, S. F. Cao, S. W. Li, Y. M. Ma, J. W. Chen, Y. Zhang, X. Q. Lu*. Amorphous carbon intercalated MoS2 nanosheets embedded on reduced graphene oxide for excellent high-rate and ultralong cycling sodium Storage. EcoMat, 2024, e12479.
274. X. F. Wei, S. F. Cao, S. H. Cheng, C. Y. Lu, X. H. Chen, X. Q. Lu, X. B. Chen*, F. N. Dai*. Unraveling the intrinsic mechanism of high-performance two-dimensional conjugated metal–organic frameworks for ORR/OER through theoretical investigation. ACS Materials Letters, 2024, 6, 3496–3504.
273. X. D. Chen#, Z. J. Wang#, S. F. Cao, X. J. Lin, C. C. Hao, X. H. Zhang, H. Y. Chen, J. Y. Wang, J. P. Liu, S. Y. Liu*, S. X. Wei, X. Q. Lu*, D. F. Sun. Steering elementary steps towards advanced alkaline hydrogen evolution via a sweet marriage of O-defected Nio and Cu. Applied Catalysis B: Environment and Energy, 2024, 357, 124295.
272. Q. K. Yin#, M. H. Wang#, H. Z. Cui, W. R. Zhai, C. F. Xia, B. J. Wei*, S. X. Wei, Z. J. Wang, S. Y. Liu, X. Q. Lu*. Hydrogen purification in nitrogen-doped two-dimensional conjugated microporous polymers. Applied Materials Today, 2024, 39, 102290.
271. H. Y. Chen#, Z. J. Wang#, H. Z. Cui, S. F. Cao, Z. X. Chen, Y. Zhang, S. X. Wei, S. Y. Liu*, B. J. Wei*, X. Q. Lu*. In-Situ construction of iron-modified nickel nanoparticles assisted by hexamethylenetetramine with the internal and external collaboration for highly selective electrocatalytic carbon dioxide reduction. Journal of Colloid and Interface Science, 2024, 672, 75-85.
270. S. F. Cao, Z. J. Wang*, S. X. Wei, S. Y. Liu, X. Q. Lu*. Tandem atomically despersed metal catalysts to promote flow-line elctrocatalytic CO2RR. Coordination Chemistry Reviews, 2024, 514, 215955.
269. H. Y. Chen, Z. X. Chen, S. F. Cao, Z. J. Wang*, X. D. Chen, X. J. Lin, Q. Hou, S. X. Wei, S. Y. Liu, B. J. Wei*, X. Q. Lu*. Embedded metal inducing electron accumulation of multi-mesoporous pyridinic-N doped carbon for enhancing *COOH adsorption in electrochemical CO2 reduction. Nano Energy, 2024, 126, 109660. (Back Cover)
268. Q. K. Yin, M. H. Wang, C. F. Xia, Q. L. Liu, X. L. Sun, B. J. Wei*, S. X. Wei, Z. J. Wang, S. Y. Liu, X. Q. Lu*. Nanoporous Ti3C2O2 monolayer towards high permeance and selectivity for CO2/N2 separation: CO2-mxene interaction tuning. Chemical Engineering Journal, 2024, 488, 151158.
267. S. F. Cao, H. Y. Chen, X. F. Wei, J. Li, C. Y. Yang, Z. X. Chen, S. X. Wei, S. Y. Liu*, Z. J. Wang, X. Q. Lu*. Asymmetric coordination engineering of active centers in mxene-based single atom catalysts for high-performance ECO2RR. Carbon, 2024, 225, 119094.
266. Z. J. Wang, R. D. Ding, J. R. Zhang, Q. Hou, H. Y. Chen, S. X. Wei, S. Y. Liu*, X. Q. Lu*. Insight into the critical role of oxygen vacancies and V=O bonds length in V2O5 for advanced zinc ion storage. ChemSusChem, 2024, e202400189.
265. F. D. Zhang, C. P. Jiao, Y. X. Shang, S. F. Cao, R. C. Sun, X. Q. Lu, Z. F. Yan*, J. B. Zeng*. In situ growth of conductive metal-organic framework onto Cu2O for highly selective and humidity-independent hydrogen sulfide detection in food quality assessment. ACS Sensors, 2024, 9, 1310–1320.
264. X. Q. Lu*, H. L. Zhang, S. Liu, L.Wang, L. Zhang, M. H. Wang*, Z. J. Wang, S. Y. Liu, S. X. Wei*. Efficient CO2 capture and separation in TpPa COFs: Synergies from functional groups and metal Li. Separation and Purification Technology, 2024, 342, 127036.
263. X. Q. Lu*, C. Y. Yang, S. F. Cao, H. Y. Chen, J. Li, Z. X. Chen, S. X. Wei, S. Y. Liu*, Z. J. Wang. Tackling the activity and selectivity challenges of electrocatalysts towards CO2 reduction reaction via atomically dispersed dual atom catalysts. Applied Surface Science, 2024, 655, 159687.
263. M. Liu, X. M. Wang, S. F. Cao, X. Q. Lu, W. Li, N. Li*, X.-H. Bu*. Ferredoxin-inspired design of S-Synergized Fe–Fe dual-metal center catalysts for enhanced electrocatalytic oxygen reduction reaction. Advanced Materials, 2024, 2309231.
262. W. Jiang, W. F. Lv, N. H. Jia, X. Q. Lu, L. Wang, K. Wang, Y. H. Mei.Study on the effects of wettability and pressure in shale matrix nanopore imbibition during shut-in process by molecular dynamics simulations. Molecules, 2024, 29, 1112.
261. P. He, H. Y. Zhu*, Q. Y. Sun, M. Li, D. Y. Liu, R. Li, X. Q. Lu, W. Zhao, Y. H. Chi, H. Ren, W. Y. Guo*. Density functional theory study of methanol steam reforming on Pt3Sn(111) and the promotion effect of a surface hydroxy group. Nanomaterials, 2024, 14, 318.
260. X. H. Zhang, X. J. Lin, S. F. Cao, X. D. Chen, Q. Hou, S. X. Wei, S. Y. Liu, Z. J. Wang*, F. N. Dai, X. Q. Lu*. Strong electron interaction at the amorphous/crystalline interface enables advanced oxygen evolution reaction. ACS Sustainable Chemistry & Engineering, 2024, 12, 3175-3184.
259. S. Liu, L. Wang, H. L. Zhang, H. X. Fang, X. K. Yue, S. X. Wei*, S. Y. Liu, Z. J.Wang, X. Q. Lu. Efficient CO2 capture and separation in MOFs: effect from isoreticular double interpenetration. ACS Applied Materials & Interfaces, 2024, 16, 7152–7160.
258. P. Guo#, S. F. Cao#, W. J. Huang#, X. Q. Lu, W. Z. Chen, Y. Z. Zhang, Y. J. Wang, X. Xin, R. Q. Zou, S. B. Liu, X. H. Li*. Heterojunction induced rapid transformation of Ni3+/Ni2+ sites which mediates urea oxidation for energy-efficient hydrogen production, Advanced Materials, 2024, 2311766.
257. M. H. Wang, L. Y. Kong, X. Q. Lu*, C.-M. L. Wu*. Coordination environment engineering to regulate the adsorption strength of intermediates in single atom catalysts for high-performance CO2 Reaction Reduction. Small, 2024, 2310339.
256. Y. Y. Wang, W. P. Kang*, X. F. Wei, X. Q. Lu, D. F. Sun*. Seed-induced strategy for the construction of nitrogen-doped carbon coated MoSe2/ZnSe-NC nanotubes with enriched phase boundaries toward boosting Na/K-ion storage. Chemical Engineering Journal, 2024, 482, 148927.
255. H. L. Zhang, S. Liu, L. Wang, H. X. Fang, X. Q. Yue, Z. J. Wang, S. X. Wei*, S. Y. Liu, X. Q. Lu*. Ultrahigh performance CO2 capture and separation in alkali metal anchored 2D-COF. Separation and Purification Technology, 2024, 333, 125937.
254. J. Q. Xu#, S. F. Cao#, M. X. Zhong, S. Y. Ren, X. J. Chen, W. M. Li, C. Wang, Z. J. Wang*, X. Q. Lu, X. F. Lu*. Rational design of bimetal phosphide embedded in carbon nanofibers for boosting oxygen evolution. Journal of Colloid and Interface Science, 2024, 657, 83–90.
2023年
253. X. J. Lin, Z. J. Wang*, S. F. Cao, Y. Y. Hu, S. Y. Liu*, X. D. Chen, H. Y. Chen, X. H. Zhang, S. X. Wei, H. Xu, Z. X. Cheng, Q. Hou, D. F. Sun, X. Q. Lu*. Bioinspired trimesic acid anchored electrocatalysts with unique static and dynamic compatibility for enhanced water oxidation. Nature Communications, 2023, 14, 6714.
252. X. F. Wei, C. H. Jiang,H. K. Xu, Y. G. Ouyang, Z. F. Wang, C. Y. Lu, X. Q. Lu, J. D. Pang*, F. N. Dai*, X. H. Bu. Synergistic effect of organic ligands on metal site spin states in 2D metal–organic frameworks for enhanced ORR performance. ACS Catalysis, 2023, 13, 5663–15672.
251. S. F. Cao, H. Y. Chen, J. Li, Z. X. Chen, C. Y. Yang, S. X. Wei, S. Y. Liu*, Z. J. Wang, X. Q. Lu*. Understanding the role of central metal and coordination environment of single atom catalysts embedded in graphene flakes on CO2RR performance. Journal of Materials Science, 2023, 58,15714–15726.
250. Z. X. Chen, S. F. Cao, J. Li, C. Y. Yang, S. X. Wei, S. Y. Liu, Z. J. Wang*, X. Q. Lu*. N,S coordination in Ni single-atom catalyst promoting CO2RR towards HCOOH. Physical Chemistry Chemical Physics, 2023, 25, 29951–29959.
249. X. H. Zhang, Q. Hou, S. F. Cao, X. J. Lin, X. Y. Chen, Z. J. Wang*, Z. J. Wang, S. Y. Liu, F. N. Dai, X. Q. Lu*. Research status, opportunities, and challenges of cobalt phosphate based materials as OER electrocatalysts. Green Chemistry, 2023, 25, 7883–7903.
248. S. X. Wei, S. Y. Xu, L. Wang, S. Liu, X. K. Yue, H. X. Fang, M. H. Wang*, S. Y. Liu, Z. J. Wang, X. Q. Lu*. Li-decorated graphdiyne for ultrahigh-performance CO2 capture and separation over N2. Separation and Purification Technology, 2023, 326, 124816.
247. Z. J. Wang, Q. Hou, X. H. Zhang, H. H. Liu, X. J. Lin, H. Y. Chen, R. D. Ding, S. X. Wei*, X. Q. Lu, S. Y. Liu*. Surface reconfiguration of silver nanoparticle doped cobalt phosphate for enhancing overall water electrocatalysis in alkali. Applied Surface Science, 2023, 639, 158165.
246. X. D. Chen, S. F. Cao, X. J. Lin, X. F. Wei, Z. J. Wang*, H. Y. Chen, C. H. Hao, S. Y. Liu*, S. X. Wei, D. F. Sun, X. Q. Lu*. Construction of Ph-universal hydrogen evolution freeway in MoO3-MoNi4@Cu core–shell nanowires via synergetic electronic and geometric effect, Nano Research, 2023, 326, 124816.
245. S. Liu, M. H. Wang, S. X. Wei*, S. Y. Liu,; Z. J. Wang, C.-M. L. Wu, D. F. Sun, X. Q. Lu, Enhanced CO2 capture in partially interpenetrated MOFs: synergistic effects from functional group, pore size, and steric-hindrance, Journal of Colloid and Interface Science, 2023, 650, 1361–1370.
244. J. Q. Xu#, S. F. Cao#, M. X. Zhong, X. J. Chen, W. M. Li, S. Yan, C. Wang, Z. J. Wang, X. Q. Lu*, X. F. Lu*. Iridium incorporated cobalt-based hydroxide on nickel-contained carbon nanofibers renders highly efficient oxygen evolution reaction, Separation and Purification Technology, 2023, 324, 124638.
243. X. Q. Lu*, Y. Y. Hu , S. F. Cao, J. Lia , C. Y. Yang, Z. X. Chen, S. X. Wei*, S. Y. Liu, Z. J. Wang*. Two-dimensional MBene: a comparable catalyst to MXene for effective CO2RR towards C1 products. Physical Chemistry Chemical Physics, 2023, 25, 18952–18959.
242. S. Y. Liu, C. C. Hao, C. Meng, S. Liu, W. R. Zhai, Q. Y. Zhu, W. C. Li, S. X. Wei*, Z. J. Wang, X. Q. Lu*. Nanoporous fluorinated covalent organic framework for efficient C2H2/CO2 separation with high C2H2 uptake. ACS Applied Nano Materials, 2023, 6, 12124–12131.
241. X. Q. Lu, J. Li, S. F. Cao, Y. Y. Hu, C. Y. Yang, Z. X. Chen, S. X. Wei, S. Y. Liu*, Z. J. Wang*. Constructing N, S and N, P co-coordination in Fe single atom catalyst for high-performance oxygen redox reactions. ChemSusChem, 2023, DOI:10.1002/cssc.202300637.
240. Z. D. Huang, S. F. Cao, F. Chao, Y. C. Li, Y. C. Liang, X. L. Li, H. Mei, W. D. Fan, B. Xu, S. Yuan*, F. N. Dai, X. Q. Lu, S. Q. Hu, D. F. Sun. Polydopamine bridging strategy enables pseudomorphic transformation of multi-component MOFs into ultrasmall NiSe/WSe2@NC heterojunctions for enhanced alkaline hydrogen evolution, Applied Catalysis B: Environmental, 2023, 334, 122769.
239. H. Dong, Q. Y. Zhu, L. Wang, X. K. Yue, H. X. Fang, Z. J. Wang, S. Y. Liu, S. X. Wei, X. Q. Lu*, Effects of shale pore size and connectivity on ScCO2 enhanced oil recovery: a molecular dynamics simulation investigation. Langmuir, 2023, 39, 6287-6299.
238. H. Y. Chen, S. F. Cao, L. Wang, X. J. Lin, Q. Y. Zhu, Y. Z. Shang, S. X. Wei, S. Y. Liu, Z. J. Wang*, B. J. Wei*, X. Q. Lu*, Selectivity switching between CO and formate for CO2 reduction on Sb modified amorphous ZnO by electronic effect. Nano Research, 2023, 16, 12144–12152.
237. Z. J. Wang, Y. Z. Shang, H. Y. Chen, S. F. Cao, Q. Y. Zhu, S. Y. Liu, S. X. Wei*, X. Q. Lu*, Toward highly active electrochemical CO2 reduction to C2H4 by copper hydroxyphosphate. Journal of Solid State Electrochemistry, 2023, 27, 1279–1287.
236. S. F. Cao, H. Y. Chen, Y. Y. Hu, J. Li, J. Li, C. Y. Yang, Z. X. Chen,S. X. Wei, S. Y. Liu*, Z. J. Wang*, D. F. Sun, X. Q. Lu*,Mxene-based single atom catalysts for efficient CO2RR towards CO: A novel strategy for high-throughput catalyst design and screening. Chemical Engineering Journal, 2023, 461, 141936.
235. S. F. Cao#,Y. C. Liu#, Y. Y. Hu, J. Li, C. Y. Yang, Z. J. Wang*, S. Y. Liu, X. Q. Lu, Precise electronic structure modulation on mxene-based single atom catalysts for high-performance electrocatalytic CO2 reduction reaction: A first-principle study. Journal of Colloid and Interface Science, 2023, 642, 273–282.
234. J. Xu*, H. Tang, S. F. Cao, X. Y. Chen, Z. Chen, Y. M. Ma, Y. Zhang, J. W. Chen, X. Q. Lu*, C.-S. Lee*. Sandwiched cathodes kinetically boosted by few-layered catalytic 1T-MoSe2 nanosheets for high-rate and long-cycling lithium-sulfur batteries. EcoMat, 2023, 5, e12329.
233. M. H. Wang, L. Y. Kong, X. Q. Lu*, C.-M. L. Wu*. Transition metal doped pyrrole-NC for high-performance CO2 reduction reaction to C1 products. Applied Surface Science, 2023, 156678.
232. X. Q. Lu, H. Xu, T. F. Yang, X. D. Chen, Z. Cheng, Q. Hou, X. J. Lin*, S. Y. Liu, S. X. Wei, Z. J. Wang*. Co3+-rich CoFe-PBA encapsulated in ultrathin MoS2 sheath as integrated core-shell architectures for highly efficient OER. Journal of Alloys and Compounds, 2023, 942, 169004.
231. Q. Y. Zhu, Y. Y. Hu, H. Y. Chen, C. Meng, Y. Z. Shang, C. C. Hao, S. X. Wei, Z. J. Wang, X. Q. Lu, S.Y. Liu*. Graphdiyne supported Ag–Cu tandem catalytic scheme for electrocatalytic reduction of CO2 to C2+ products. Nanoscale, 2023, 15, 2106–2113.
230. H. L. Li#, S. F. Cao#, H. M. Sun#, Y. L. Lu, Y. Zhang, X. Q. Lu*, J. B. Zeng*, Z. F. Yan*. CuNCN derived Cu-based/CxNy catalysts for highly selective CO2 electroreduction to hydrocarbons. Applied Catalysis B: Environmental, 2023, 320, 121948.
229. W. Duan#, J. L. Wang#, X. M. Peng, S. F. Cao, J. J. Shang, Z. W. Qiu, X. Q. Lu, J. B. Zeng*. Rational design of trimetallic AgPt–Fe3O4 nanozyme for catalyst poisoning-mediated CO colorimetric detection, Biosensors and Bioelectronics, 2023, 223, 115022.
228. L. Wang, W. F. Lyu, Z. M. Ji, L. Wang, S. Liu, H. X. Fang, X. K. Yue, S. X. Wei*, S. Y. Liu, Z. J. Wang, X. Q. Lu*.Molecular dynamics insight into the CO2 flooding mechanism in wedge-shaped pores, Molecules, 2023, 28, 188.
2022年
227. S. X. Wei, H.L.Xin, M. H. Wang*, S. Y. Xu, W. R. Zhai, S. Liu, L. Wang, S. Y. Liu, Z. J. Wang, X. Q. Lu*. Functionalized 3D covalent organic frameworks for high-performance CO2 capture and separation over N2, Advanced Theory Simulations, 2022, 5, 2200588.
226. Y. T. Wang, M. Y. Fu, S. N. Zhou, H. Y. Liu, X. K. Wang, W. D. Fan*, Z. N. Liu, Z. K. Wang, D. C. Li, H. G. Hao, X. Q. Lu, S. Q. Hu, D. F. Sun*. Guest-molecule-induced self-adaptive pore engineering facilitates purification of ethylene from ternary mixture. Chem, 2022, 5, 2200588.
225. W. Yan, S. F. Cao, H. Y. Liu*, Q. L. Xing, J. W. Ren, Z. Li, X. Y. Li*, X. Q. Lu, Y. L. Chen*. A facile solid-phase method for preparing a highly active and stable PtZn-based oxygen reduction/hydrogen evolution bifunctional electrocatalyst: effect of bi-facet lattice strain on catalytic activity. ACS Applied Energy Materials, 2022, 5, 13791–13801.
224. H. Y. Chen, Y. Zhang, T. F. Yang, Y. Z. Shang, Q. Y. Zhu, S. F. Cao, X. J. Lin, S. Y. Liu, S. X. Wei, B. J. Wei*, Z. J. Wang*, X. Q. Lu*. Two birds with one stone: large catalytic areas and abundant nitrogen sites inspired by fluorine doping contributing to CO2RR activity and selectivity. Dalton Transactions, 2022, 51, 15883.
223. X. F. Wei, S. F. Cao, H. K. Xu, C. H. Jiang, Z. F. Wang, Y. G. Ouyang, X. Q. Lu, F. N. Dai*, D. F. Sun. Novel two-dimensional metal organic frameworks: high-performance bifunctional electrocatalysts for oer/orr. ACS Materials Letters, 2022, 4, 1991–1998.
222. S. Y. Xu#, S. X. Wei#, L. Wang, S. Liu, M. H. Wang*, S. Y. Liu, Z. J. Wang, T. F. Yang*, X. Q. Lu*. Li-decorated β1-graphyne for high-performance CO2 capture and separation over N2. Applied Surface Science, 2022, 605, 154724.
221. L. L. Fan#*, X. F. We#, X. T. Li, Z. N. Liu, M. F. Li, S. Liu, Z. X. Kang, F. N. Dai, X. Q. Lu, D. F. Sun*. Phosphorus-doped iron-nitrogen-carbon catalyst with penta-coordinated single atom sites for efficient oxygen reduction. Nano Research, 2022, 16, 1810–1819.
220. C. Qiu, K. Qian, J. Yu*, M. Z. Sun, S. F. Cao, J. Q. Gao, R. X. Yu, L. Z. Fang, Y. W. Yao, X. Q. Lu, T. Li*, B. L. Huang*, S. H. Yang*. MOF-transformed In2O3-x@C nanocorn electrocatalyst for efficient CO2 reduction to HCOOH. Nano-Micro Letters, 2022, 14, 167.
219. J. R. Zhang, S. Y. Liu, S. N. Zhou, H. H. Liu, R. D. Ding, S. X. Wei, Z. J. Wang*, X. Q. Lu*. A novel inorganic-organic hybrid cathode for aqueous zinc ion batteries: V2O5 pillared with diethylenetriamine like a double-stud. ACS Sustainable Chemistry & Engineering, 2022, 10, 10243–10251.
218. W. R. Zhai, M. H. Wang*, S. Liu, S. Y. Xu, H. Dong, L. Wang, S. X. Wei, Z. J. Wang*, S. Y. Liu, X. Q. Lu*. Theoretical investigation on two-dimensional conjugated aromatic polymer membranes for high-efficiency hydrogen separation: the effects of pore size and interaction. Separation and Purification Technology, 2022, 299, 121674.
217. M. H. Wang, S. X. Wei*, S. Liu, Z. J. Wang, X. Q. Lu*. Interlayer expansion in a layered metal–organic framework enhances CO2 Capture and CO2/N2 Separation. ChemPhysChem, 2022, 23, e202200298.
216. J. R. Zhang, S. Y. Liu, H. H. Liu, S. N. Zhou, R. D. Ding, S. X. Wei, Z. J. Wang*, X. Q. Lu*. Methyl-functionalized hydrangea-like vanadium pentoxide cathode for aqueous zinc ion batteries with high-rate and long-term cycling stability. Journal of Alloys and Compounds, 2022, 920, 166010.
215. S. F. Cao#, Y. Y. Hu#, C. Y. Yang, J. Li, H.Y. Chen, S.X. Wei, S. Y. Liu*, Z. J. Wang, D. F. Sun, X. Q. Lu*. Constructing surface vacancy to activate the stuck MXenes for high-performance CO2 reduction reaction. Journal of CO2 Utilization, 2022, 62, 102074.
214. Q. Liu, S. F. Cao, Q. Q. Sun, C. W. Xing, W. Gao, X. Q. Lu, X. Y. Li, G. W. Yang*, S. R.Yu, Y. L. Chen*. A perylenediimide modified SiO2@TiO2 yolk-shell light-responsive nanozyme: improved peroxidase-like activity for H2O2 and sarcosine sensing. Journal of Hazardous Materials, 2022, 436, 129321.
213. H. H. Liu#, S. Y. Liu#, S. F. Cao, J. R. Zhang, H. Ni, X. J. Lin, X. D. Chen, S. X. Wei, Q. Hou, Z. J. Wang*, X. Q. Lu*. Phosphate group dependent metallic Co(OH)2 towards hydrogen evolution in alkali for the industrial current density. ACS Sustainable Chemistry & Engineering, 2022, 10, 7100–7107.
212. W. F. Lyu, L. H. Sun, L. Wang, Z. M. Ji, S. N. Zhou, Y. Chen*, X. Q. Lu*. Nitrogen atom-doped layered graphene for high-performance CO2/N2 adsorption and separation. Energies, 2022, 15, 3713.
211. B. B. Guo, H. Y. Liu, J. Pang, Q. Lyu, Y. T. Wang, W. D. Fan*, X. Q. Lu, D. F. Sun. Tunable rare-earth metal−organic frameworks for ultra-high selenite capture. Journal of Hazardous Materials, 2022, 436, 129094.
210. X. J. Lin, S. F. Cao, X. D. Chen, H. Y. Chen, Z. J. Wang*, H. H. L, H. Xu, S. Y. Liu*, S. X. Wei, X. Q. Lu*. Two birds with one stone: contemporaneously boosting OER activity and kinetics for layered double hydroxide inspired by photosystem II. Advanced Functional Materials, 2022, 32, 2202072.
209. X. F. Wei, S. F. Cao, S. X. Wei, S. Y. Liu, Z. J. Wang, F. N. Dai*, X. Q. Lu*. Theoretical investigation on electrocatalytic reduction of CO2 to methanol and methane by bimetallic atoms TM1/TM2-N@Gra (TM = Fe, Co, Ni, Cu). Applied Surface Science, 2022, 593, 153377.
208. S. N. Zhou, M. H. Wang, S. X. Wei*, Z. J. Wang, S. Y. Liu, C.-M. L. Wu, D. F. Sun, X. Q. Lu*. Precise regulation of CO2 packing pattern in s-block metal doped single-layer covalent organic frameworks for high-performance CO2 capture and separation, Chemical Engineering Journal, 2022, 441, 135903.
207. P. Guo, S. F. Cao, Y. J. Wang, X. Q. Lu, Y. Z. Zhang, X. Xin, X. Chi, X. J. Yu, I. Tojiboyev, H. Salari, A. J. Sobrido, M. Titirici, X. H. Li*. Surface self-reconstruction of telluride induced by in-situ cathodic electrochemical activation for enhanced water oxidation performance, Applied Catalysis B: Environmental, 2022, 310, 121355.
206. M. H. Wang, L. Y. Kong, X. Q. Lu*, C.-M. L. Wu*. First-row transition metal embedded pyrazinebased graphynes as high-performance single atom catalysts for the CO2reduction reaction, Journal of Materials Chemistry A, 2022, 10, 9048–9058.
205. H. L. Xin#, S. N. Zhou#, S. Y. Xu, W. R. Zhai, S. Liu, S. Y. Liu, Z. J. Wang, X. Q. Lu, S. X. Wei*. Functionalized linker to form high-symmetry adsorption sites in micropore COF for CO2 capture and separation: insight from GCMC simulations, Journal of Materials Science, 2022, 57, 6282–6292.
204. J. X. Chen#, X. F. Wei#, R. M. Cai, J. Z. Ren, M. Ju, X. Q. Lu, X. Long*, S. H. Yang*. Composition-tuned surface binding on CuZn-Ni catalysts boosts CO2RR selectivity toward CO generation. ACS Materials Letters, 2022, 4, 497–504.
203. Z. W. Qiu#, W. Duan#, S. F. Cao, T. Zeng, T. Y. Zhao, J. K. Huang, X. Q. Lu, J. B. Zeng*. Highly specific colorimetric sensor for fluoride by triggering the intrinsic catalytic activity of AgPt-Fe3O4 hybrid nanozyme packaged in SiO2 shells. Environmental Science & Technology, 2022, 56, 1713–1723.
202. X. J. Lin, S. F. Cao, H. Y. Chen, X. D. Chen, Z. J. Wang*, S. N. Zhou, H. Xu, S. Y. Liu, S. X. Wei, X. Q. Lu*. Boosting oxygen evolution reaction of hierarchical spongy NiFe-PBA/Ni3C(B) electrocatalyst: Interfacial engineering with matchable structure. Chemical Engineering Journal, 2022, 433, 133524.
201. M. H. Wang, L. Y. Kong, X. Q. Lu*, C.-M. L. Wu*. Can charge-modulated metal-organic frameworks achieve high-performance CO2 capture and separation over H2, N2 and CH4? ChemSusChem, 2022, 15, e202101674.
200. M. Liu, N. Li, S. F. Cao, X. M. Wang, X. Q. Lu, L. J. Kong, Y. H. Xu, X. H. Bu*. A “pre-constrained metal twins” strategy to prepare efficient dual-metal atom catalysts for cooperative oxygen electrocatalysis, Advanced Materials, 2022, 2107421.
199. Y. Y. Wang#, W. P. Kang#*, X. J. Pu, Y. C. Liang, B. Xu, X. Q. Lu, D. F. Sun, Y. L. Cao*. Template-directed synthesis of Co2P/MoSe2 in a N-doped carbon hollow structure for efficient and stable sodium/potassium ion storage. Nano Energy, 2022, 93, 106897.
198. Z. J. Wang, J. R. Zhang, H. W. Wang, X. F. Wei, J. B. Zhang, H. Y. Chen, S. Y. Liu*, S. X. Wei*, X. Q. Lu*. Hydrothermal synthesis of ammonium vanadate [(NH4)2V7O16•3.6H2O] as a promising zinc-ion cathode: Experimental and theoretical study of its storage, Electrochimica Acta, 2022, 404, 139785.
197. W. Duan#, Z. W. Qiu#, S. F. Cao#, Q. Guo, J. K. Huang, J. Y. Xing, X. Q. Lu*, J. B. Zeng*. Pd–Fe3O4 Janus nanozyme with rational design for ultrasensitive colorimetric detection of biothiols. Biosensors & Bioelectronics, 2022, 196, 113724.
196. H. H. Liu#, S. Y. Liu#, Y. K. Zou, X. Zhang, P. Guo, J. R. Zhang, Z. J. Wang*, S. F. Cao, S. X. Wei, X. Q. Lu*. Synergistic doping and tailoring: realizing in depth modulation on valence state of CoFe spinel oxide for high-efficiency water oxidation. Applied Surface Science, 2022, 572, 151388.
195. S. F. Cao, S. N. Zhou, H. Y. Chen, S. X. Wei, S. Y. Liu*, X. J. Lin, X. D. Chen, Z. J. Wang, W. Y. Guo, X. Q. Lu*. How can the dual-atom catalyst FeCo‒NC surpass single-atom catalysts Fe‒NC/Co‒NC in CO2RR? CO intermediate assisted promotion via a synergistic effect, Energy & Environmental Materials, 2021, DOI: 10.1002/eem2.12287.
2021年
194.S. N. Zhou, S. F. Cao, S. X. Wei,Z. J. Wang*, H. Y. Chen, X. J. Lin, X. D. Chen, S. Y. Liu,X. Q. Lu*. Triple-atom catalysts 3TM-GYs (TM = Cu, Fe, andCo; GY = graphyne) for high-performance CO2 reduction reaction to C1 products. Applied Materials Today, 2021, 25, 101245.
193. S. X. Wei, S. Y. Liu*, S. F. Cao, S. N. Zhou, Y. Chen*, Z. J. Wang, X. Q. Lu*. Theoretical investigation of the fusion process of mono-cages to tri-cages with CH4/C2H6 guest molecules in sI hydrates, Molecules, 2021, 26, 7071.
192. X. T. Li#, L. L. Fan#*, B. Xu, Y. X. Shang, M. F. Li, L. Zhang, S. Liu, Z. X. Kang, Z. N. Liu, X. Q. Lu, D. F. Sun*. Single-atom-like B-N3 sites in ordered macroporous carbon for efficient oxygen reduction reaction. ACS Applied Materials & Interfaces,2021, 13, 53892–53903.
191. H. B. Zhang, H. Mei, D. K. Qin, Z. Y. Li, Z. Y. Hou, X. Q. Lu, B. Xu*, D. F. Sun*. Conversion of amorphous MOF microspheres into Nickel Phosphate battery-type electrode through the “anti-collapse” two-step strategy. Inorganic Chemistry, 2021, 60, 17094–17102.
190. H. Y. Chen#, Z. J. Wang#, S. F. Cao, S. Y. Liu, X. J. Lin, Y. Zhang, Y. Z. Shang, Q. Y. Zhu, S. N. Zhou, S. X. Wei, B. J. Wei*, D. F. Sun, X. Q. Lu*. Facile synthesis of antimony-doped Cu/Cu2O catalyst with robust CO production in broad potentials for CO2 electrochemical reduction. Journal of Materials Chemistry A, 2021, 9, 23234–232421.
189. S. N. Zhou, M. H. Wang, S. X.Wei*, H. L. Xin, W. R. Zhai, S. Y. Xu,S. Liu,S. Y. Liu, Z. J. Wang,C.-M. L. Wu,X. Q. Lu*. Multi-objective optimization of alkali/alkaline earth metals doped graphyne for ultrahigh-performance CO2 capture and separation over N2/CH4, Materials Today Physics, 2021, 21, 100539.
188.J. W. Wang, S. F. Cao, L. K. Yang, Y. Zhang, K. Xing, X. Q. Lu*, J. Xu*. Metastable marcasite NiSe2 nanodendrites on carbon fiber clothes to suppress polysulfide shuttling for high-performance lithiumsulfur batteries. Nanoscale,2021, 13, 16487–16498.
187. H. Mei , H. B. Zhang, Z. Y. Li, L. Zhang, X. Q. Lu, B. Xu*, D. F. Sun*. Enabling kinetic-fast activation of CNT@nickel selenide via pore-phase dual regulation in aqueous Zinc battery, Science China Materials, 2022, 65, 929–938.
186. L. Zhang#, X. Y. Cao#, C. Feng, W. Y. Zhang, Z. F. Wang, S. J. Feng, Z. D. Huang*, X. Q. Lu, F. N. Dai*. Interfacial Mo–N–C Bond Endowed Hydrogen Evolution Reaction on MoSe2@N-Doped Carbon Hollow Nanoflowers, Inorganic Chemistry, 2021, 60, 12377–12385.
185. X. F. Wei#, S. X. Wei#, S. F. Cao, Y. Y. Hu, S. N. Zhou, S. Y. Liu, Z. J. Wang*, X. Q. Lu*. Cu acting as Fe activity promoter in dual-atom Cu/Fe‒NC catalyst in CO2RR to C1 products, Applied Surface Science, 2021, 564, 150423.
184.H. H. Liu#, S. F. Cao#,J. R. Zhang, S. Y. Liu, C. Chen, Y. Zhang, S. X. Wei, Z. J. Wang*, X. Q. Lu*. Facile control of surface reconstruction with Co2+ or Co3+-rich (oxy)hydroxide surface on ZnCo phosphate for large-current-density hydrogen evolution in alkali, Materials TodayPhysics, 2021, 20, 100448.
183. S. F. Cao, S. X. Wei*, X. F. Wei, S. N. Zhou, H. Y. Chen, Y. Y. Hu, Z. J. Wang, S. Y. Liu, W. Y. Guo, X. Q. Lu*. Can N, Scocoordination promote single atom catalyst performance in CO2RR? Fe‒N2S2 porphyrin vs. Fe‒N4 porphyrin, Small, 2021,17, 2100949.
182. C.Guo, T. Zhang, X. Q. Lu*, C.-M. L. Wu*. Rational design and effective control of gold‐based bimetallic electrocatalyst for boosting CO2 reduction reaction: a first principles study, ChemSusChem, 2021,14, 2731–2739.
181. J. Xu*, L. K. Yang, S. F. Cao, J. W. Wang, Y. You, K. Xing, J. J. Zhang*, X. Q. Lu*. Sandwiched cathodes assembled from CoS2-modefied carbon clothes for high-performance lithium-sulfur batteries. Advanced Science, 2021, 8, 2101019.
180. J. R. Zhang#, S. X. Wei#, H. W. Wang, H. H. Liu, Y. Zhang, S. Y. Liu, Z. J. Wang*, X. Q. Lu*. Carbon quantum dots promote coupled valence engineering of V2O5 nanobelts for high performance aqueous zinc-ionbatteries, ChemSusChem, 2021, 14, 2076–2083.
179. M. H. Wang, W. R. Zhai, S. N. Zhou, X. Q. Lu*, C. M. L. Wu*. Strain-controlled DHP-graphene for ultrahigh-performance hydrogen purification, Applied Surface Science, 2021, 553, 149575.
178. F. G. Li, C. P. Liu, D. Q. Yuan, F. N. Dai, R. M. Wang, Z. K. Wang, X. Q. Lu, D. F. Sun*. Superhigh hydrogen uptake in an interpenetrated Zn4O-based metal-organic framework, CCS Chemistry, 2021,3, 1005–1011.
177. W. Yan, S. F. Cao, Z. X. Xiao, F. N. Dai, T. Xing, Z. Li, Y. L. Chen*, X. Q. Lu*, X. Y. Li*. Novel heteroatom sulfur porphyrin organic polymer as a metal-free electrocatalyst for acidic oxygen reduction reaction, Electrochimica Acta, 2021, 377, 138107.
176. Y. T. Wang, C. L. Hao, W. D. Fan, M. Y. Fu, X. K. Wang, Z. K. Wang, L. Zhu, Y. Li, X. Q. Lu, F. N. Dai, Z. X. Kang, R. M. Wang,W. Y. Guo, S. Q. Hu, D. F. Sun*. One-step ethylene purification from an acetylene/ethylene/ethane ternary mixture by cyclopentadiene cobalt‐functionalized metal‐organic frameworks, Angewandte Chemie International Edition, 2021, 60, 11350–11358.
175. X. F. Liu, M. H. Wang*, S. N. Zhou, J. H. Wang, H. L. Xin, S. X. Wei*, S. Y. Liu, Z. J. Wang, X. Q. Lu*. Tracking CO2 capture and separation over N2 in a flexible metal–organic framework: insights from GCMC and DFT simulations. Journal of Materials Science,2021, 56, 10414–10423.
174. W. T. Wu*, Y. C. Xing, Z. Yao, W. Y. Li, X. Q. Lu, J. Tian, Z. T. Li, H. Hu, M. B. Wu. Fe/Fe3C boost H2O2 utilization for methane conversion overwhelming O2 generation, Angewandte Chemie International Edition, 2021,60, 8889–8895.
173. H. Y. Chen#, Z. J. Wang#, X. F. Wei, S. Y. Liu, P. Guo, P. Han*, H. W. Wang, J. B. Zhang, X. Q. Lu*, B. J. Wei*. Promotion of electrochemical CO2 reduction to ethylene on phosphorus-doped copper nanocrystals with stable Cuδ+ sites. Applied Surface Science, 2021, 544, 148965.
172. Z. J. Wang#, P. Guo#, S. F. Cao, H. Y. Chen, S. N. Zhou, H. H. Liu, H. W. Wang, J. B. Zhang, S. Y. Liu, S. X. Wei, X. Q. Lu*. Contemporaneous inverse manipulation of the valence configuration to preferred Co2+ and Ni3+ for super-active overall waterelectrocatalysis, Applied Catalysis B: Environmental, 2021, 284, 119725.
171. Z. X. Xiao, Y. L. Wu, S. F. Cao, W. Yan, B. T. Chen, T. Xing, Z. Li, X. Q. Lu, Y. L. Chen*, K. Wang*, J. Z. Jiang*. An active site pre-anchoring and post-exposure strategy in Fe(Cn)64-@Ppy derived Fe/S/N-doped carbon electrocatalyst for high performance oxygen reduction reaction and zinc-air batteries. Chemical Engineering Journal, 2021, 413, 127395.
170. S. N. Zhou, M. H. Wang, S. X. Wei, S. F. Cao, Z. J. Wang*, S. Y. Liu, D. F. Sun, X. Q. Lu*.First-row transition-metal-doped graphyne for ultrahigh-performance CO2 capture and separation over N2/CH4/H2, Materials Today Physics, 2021,16, 100301.
2020年
169. J. Xu*, B. S. Yu, H. Zhao, S. F. Cao, L. L. Song*, K. Xing, R. Zhou, X. Q. Lu*. Oxygen-doped VS4 microspheres with abundant sulfur vacancies as a superior electrocatalyst for hydrogen evolution reaction, ACS Sustainable Chemistry & Engineering, 2020, 8, 15055–15064.
168. X. Q. Lu*, S. F. Cao, X. F. Wei, S. R. Li, S. X. Wei*. Investigation on oxygen reduction reaction mechanism on S doped Fe-NC isolated single atoms sites catalyst, Acta Chimica Sinica, 2020, 78, 1001–1006.
167. X. Q. Lu#*, M. H. Wang#, S. N. Zhou, Z. J. Wang, H. L. Xin, Z. J. Wang, S. Y. Liu, S. X. Wei*. High-efficiency CO2 capture and separation over N2 in penta-graphene pores, Journal of Materials Science, 2020, 55, 16603–16611.
166. C. Guo, T. Zhang, X. Y. Liang, X. X. Deng, W. Y. Guo, Z. J. Wang, X. Q. Lu*, C.-M. L. Wu*. Single transition metal atoms on nitrogen-doped carbon for CO2 electrocatalytic reduction: CO production or further CO reduction? Applied Surface Science, 2020, 533, 147466.
165. Z. J. Xu*, X. Q. Lu*, L. Xiong, Y. Y. Li, S. X. Wei*. Theoretical analysis on heterolepticCu(I)-based complexes for dye-sensitized solar cells:effect of anchors on electronic structure, spectrum, excitation, intramolecular and interfacial electron transfer, Molecules, 2020, 25, 3681.
164. S. Y. Liu, M. Légaré, J. Seufert, D. Prieschl, A. Rempel, L. Englert, T. Dellermann, V. Paprocki, A. Stoy, H. Braunschweig*. 2,2′-bipyridyl as a redox-active borylene abstraction agent, Inorganic Chemistry, 2020, 59, 15, 10866–10873.
163. Q. D. Zhang#, S. X. Wei#, S. N. Zhou, X. F. Wei, Z. J. Xu, Z. J. Wang, B. J. Wei*, X. Q. Lu*. Theoretical investigation on copper(I) complexes featuring phosphonic acid anchor with asymmetric ligands for DSSC, ACS Applied ElectronicMaterials, 2020, 2, 2141–2150.
162. Z. J. Xu,* S. L. Gao, X. Q. Lu, Y. Y. Li, Y. M. Li, S. X. Wei*. Theoretical analysis on absorption spectrum, electronic structure, excitation, and intramolecular electron transfer of D-A-pi-A porphyrin dyes for dye-sensitized solar cells. Physical Chemistry Chemical Physics,2020, 22, 14846–14856.
161. S. Y. Liu, M. Légaré, A. Hofmann, T. Dellermannbc, H. Braunschweig*. Transition-metal-carbene-like intermolecular insertion of a borylene into C–H bonds. Chemical Communications, 2020, 56, 7277–7280.
160. M. H. Wang#, S. N. Zhou#, S. F. Cao, Z. J. Wang*, S. Y. Liu, S. X. Wei, X. Q. Lu*. Stimulus-responsive adsorbent materials for CO2 capture and separation. Journal of Materials Chemistry A, 2020, 8, 10519–10533.
159. S. N. Zhou#, M. H. Wang#, J . H. Wang, H. L. Xin, S. Y. Liu*, Z. J. Wang, S. X. Wei, X. Q. Lu*. Carbon phosphides: promising electric field controllable nanoporous materials for CO2 capture and separation. Journal of Materials Chemistry A, 2020, 8, 9970–9980.
158. Z. F. Tang, S. N. Zhou, H. Y. Liu,* X. Y. Wang, S. S. Liu, L. Shen, X. Q. Lu, X. Y. Li*, Tuning singlet fission in amphipathic tetracene nanoparticles by controlling molecular packing with side-group engineering. Materials Chemistry Frontiers, 2020, 4, 2113–2125.
157. Z. D. Huang#, S. Yuan#, T. T. Zhang, B. Cai, B. Xu, X. Q. Lu, L. L. Fan, F. N. Dai, D. F. Sun*. Selective selenization of mixed-linker Ni-MOFs: NiSe2@NC core-shell nano-octahedrons with tunable interfacial electronic structure for hydrogen evolution reaction. Applied Catalysis B: Environmental, 2020, 272, 118976.
156. H. J. Liu#, Z. J. Wang#*, Z. H. Wu, S. Zhang, S. H. Ge, P. Guo, M. L. Hua, X. Q. Lu*, S .T. Wang, J. Zhang*. Direct tuning of meso-/micro-porous structure of carbon nanofibers confining Sb nanocrystals for advanced sodium and potassium storage. Journal of Alloys and Compounds, 2020, 833, 155127.
155. P. Guo#, Z. J. Wang#*, S. H. Ge, H. Y. Chen, J. B. Zhang, H. W. Wang, S. Y. Liu*, S. X. Wei, X. Q. Lu*. In situ coupling reconstruction of Cobalt–Iron oxide on a cobalt phosphate nanoarray with interfacial electronic features for highly enhanced water oxidation catalysis. ACS Sustainable Chemistry & Engineering, 2020, 8, 4773–4780.
154. H. Y. Zhu, Y. C. Yu, G. X. Li, X. Q. Lu*, D. Y. Liu, X. F. Ding, L. M. Zhao,Y. H. Chi, W. Y. Guo*. Unraveling the active site and mechanism for C-S bond activation in Alumina-supported Pt catalysts: Ab-initio insights into catalytic desulfurization. The Journal of Physical Chemistry C, 2020, 124, 446– 458.
153. Z. J. Xu⁎, Y. M. Li, Y. Y. Li, S. D. Yuan, L. Z. Hao, S. L. Gao, X. Q. Lu*.Theoretical study of T shaped phenothiazine/carbazole based organic dyes with naphthalimide as π-spacer for dsscs. Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 2020, 233, 118201.
152. H. Y. Zhu, G. X. Li, Y. Q. Gong, X. Li, X. F. Ding, X. Q. Lu*, L. M. Zhao, Y. H. Chi, W. Y. Guo*. Theoretical investigation on denitrification mechanism of piperidine: effects of methylation vs. protonation on C-N bond activation, Catalysis Letters, 2020, 150, 631 – 639.
151. T. Zhan#, H. Y. Zhu#, C. Guo, S. F. Cao, C.-M. L. Wu*,Z. J. Wang, X. Q. Lu*.Theoretical investigation on hydrogen evolutionreaction mechanism at MoS2 heterostructure: the essential role of 1T/2H phase interface. Catalysis Science & Technology, 2020, 10, 458–465.
150. M. H. Wang#, Z. J. Wang#, S. N. Zhou, J. H. Wang, S. X. Wei*, W. Y. Guo, X. Q. Lu*. Strain-controlled carbon nitride: a continuously tunable membrane for gas separation. Applied Surface Science, 2020, 506, 144675.
149. M. H. Wang, Z, Y. Zhang, Y. Q. Gong, S. N. Zhou, J. H. Wang, Z. J. Wang*, S. X. Wei, W. Y. Guo, X. Q. Lu*. Penta-graphene as a promising controllable CO2 capture and separation material in an electric field, Applied Surface Science, 2020, 502, 144067.
148. X. Q. Lu*, M. H. Wang, Theoretical investigation on adsorption and separation of CO2/N2 in hybrid ultramicroporous materials, Journal of Inorganic Materials, 2020, 35, 469–474.
2019年
147. P. Guo, Z. J. Wang*, T. Zhang, C. Chen, Y. L. Chen, H. J. Liu, M. L. Hua, S. X. Wei, X. Q. Lu*. Initiating an efficient electrocatalyst for water splitting via valence configuration of low-crystallinity Cobalt-Iron oxide, Applied Catalysis B: Environmental, 2019, 258, 117968.
146. C. Guo, T. Zhang, X. X. Deng, X. Y. Liang, W. Y. Guo, X. Q. Lu*, C.-M. L. Wu*. Electrochemical CO2 reduction to C1 products on single Nickel/Cobalt/Iron doped graphitic carbon nitride: a DFT Study, ChemSusChem, 2019, 12, 5126 – 5132.
145. P. Guo, Z. J. Wang*, H. Y. Chen, S. H. Ge, C. Chen, H. W. Wang, J. B. Zhang, M. L. Hua, S. X. Wei, X. Q. Lu*. In situ growth of Mof-derived NaCoPo4@Carbon for asymmetric supercapacitive and water oxidation electrocatalytic performance. Nano, 2019, 1950148.
144. Z. F. Tang, S. N. Zhou, X. Y. Wang, H. Y. Liu*, X. Y. Yan, S. S. Liu, X. Q. Lu, X. Y. Li*. Enhancing the intermolecular singlet fission efficiency by controlling self-assembly of amphipathic tetracene derivatives in aqueous solution, Journal of Materials Chemistry C, 2019, 7, 11090–11098.
143. S. N. Zhou#, Z. J. Wang#, M. H. Wang, J. H. Wang, S. X. Wei*, W. Y. Guo, X. Q. Lu*. Boron nitride membranes towards ultra-high selective helium separation, ACS Applied Nano Materials, 2019, 2, 4471–4479.
142. L. L. Fan, X. X. Du, S. N. Zhou, M. F. Li, Z. X. Kang, H. L. Guo, W. D. Fan, L. Zhang, X. Q. Lu*, D. F. Sun*. Efficient harvesting of platinum by N-doped carbon for hydrogen evolution reaction, Electrochimica Acta, 2019, 317, 173–181.
141. Z. J. Wang, P. Guo, M. Liu, C. Guo, H. J. Liu, S. X. Wei, J. Zhang, X. Q. Lu*, Rational design of metallic NiTex (x=1 or 2) as bifunctional electrocatalysts for efficient urea conversion, ACS Applied Energy Materials, 2019, 2, 3363–3372.
140. Y. Z. Wu, Q. D. Zhang, J. Li, X. Tian, D. Li, X. Q. Lu, B. S. Xu, Y. C. Wu, K. P. Guo. Regulation of dithiafulvene-based molecular shape and their aggregations on TiO2 for high efficiency dye-sensitized solar cells. Journal of Materials Chemistry C, 2019, 7, 1974–1981.
139. Z. J. Xu, Y. Y. Li, W. J. Zhang, S. D. Yuan, L. Z. Hao, T. Xu, X. Q. Lu*. DFT/TD-DFT study of novel T shaped phenothiazine-based organic dyes for dye-sensitized solar cells applications. Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 2019, 212, 272–280.
138. C. Guo, T. Zhang, M. Niu*, S. F. Cao, S. X. Wei, Z. J. Wang, W. Y. Guo, X. Q. Lu*, C.-M. L. Wu*. Impact of Diverse Active Sites on MoS2 Catalyst: Competition on Active Site Formation and Selectivity of Thiophene Hydrodesulfurization Reaction, Molecular Catalysis, 2019, 463, 67–76.
2018年
137. Z. H. Wu, S. X. Wei, M. H. Wang, S. N. Zhou, J. H. Wang, Z. J. Wang*,W. Y. Guo, X. Q. Lu*. CO2 Capture and Separation over N2 and CH4 in Nanoporous MFM-300(In, Al, Ga, and In-3n): Insight from GCMC Simulations. J. CO2 Util., 2018, 28, 145–151.
136. Y. L. Chen, J. T. Zhang, P. Guo, H. J. Liu, Z. J. Wang, M. Liu, T. Zhang, S. T. Wang, Y. Zhou, X. Q. Lu, J. Zhang. Coupled heterostructure of Mo-Fe selenide nanosheets supported on carbon paper as an integrated electrocatalyst for efficient hydrogen evolution, ACS Appl. Mater. Interfaces, 2018, 10, 27787–27794.
135. Y. J. Xiao, X. Q. Lu, S. P. Ng; C.-M. L. Wu. Trivacancy and Stone-Wales Defected Silicene for Adsorption of Small Gas Molecules. Comp. Mater. Sci., 2018, 154, 276–283.
134. H. J. Liu, S. Zhang, Y. L. Chen, J. T. Zhang, P. Guo, M. Liu, X. Q. Lu, J. Zhang, Z. J. Wang. Rational design of TiO2@Nitrogen-doped carbon coaxial nanotubes as anode for advanced lithium ion batteries. Appl. Surf. Sci., 2018, 458, 1018–1025.
133. M. H. Wang, S. X. Wei, Z. H. Wu, S. N. Zhou, Z. J. Wang,* J. H. Wang, X. Q. Lu*. Alkyl amine functionalized triphenylamine-based covalent organic frameworks for high-efficiency CO2 capture and separation over N2. Mater. Lett., 2018, 230, 28–31.
132. X. F. Liu, S. X. Wei, S. N. Zhou, Z. H. Wu, M. H. Wang, Z. J. Wang,* J. H. Wang, X. Q. Lu*. Li-modified nanoporous carbons for high-performance adsorption and separation of CO2 over N2: a combined DFT and GCMC computational study. J. CO2 Util., 2018, 26, 588–594.
131. N. Wang, J. Wang, J. H. Hu, X. Q. Lu*, J. Sun, F. Shi, Z. H. Liu, Z. B. Lei, R. B. Jiang. Design of palladium-doped g-C3N4 for enhanced photocatalytic activity towards hydrogen evolution reaction, ACS Appl. Energy Mater., 2018, 1, 2866–2873.
130. F. Zhang, R. Zhang, X. Z. Liang, K. P. Guo, Z. X. Han, X. Q. Lu, J. J. Xie, J. Li, D. Li, X. Tian. 1, 3-Indanedione functionalized fluorene luminophores: Negative solvatochromism, nanostructure-morphology determined AIE and mechanoresponsive luminescence turn-on, Dyes Pigments, 2018, 155, 225–232.
129. S. X. Wei, S. N. Zhou, Z. H. Wu, M. H. Wang, Z. J. Wang,* W. Y. Guo, X. Q. Lu*, Porous graphene membranes for high-efficiency helium separation and hydrogen purification. Appl. Surf. Sci., 2018, 441, 631–638.
128. Z. J. Wang, M. Liu, J. Du, G. J. Wei, Y. Lin, S. X. Wei, X. Q. Lu*, J. Zhang. A facile co-precipitation synthesis ofrobust FeCo phosphate electrocatalysts for efficient oxygen evolution, Electrochim. Acta, 2018, 264, 244–250.
127. M. Wu, J. Li, R. Q. Zhang, X. Tian, Z. X. Han, X. Q. Lu, K. P. Guo, Z. K. Liu, Z. Q. Wang. Synthesis and Properties of Dithiafulvenyl Functionalized Spiro[fluorene-9,9′-xanthene] Molecules, Org. Lett. 2018, 20, 780–783.
126. S. X. Wei, Z. H. Wu, X. Q. Lu*, Theoretical study on the edge-functionalization effect on nanoporous carbons for adsorption capacity and selectivity of CO2 over N2. IOP Conference Series: Mate. Sci. Engineering, 2018, 284, 012015.
125. T. Zhang, C. Guo, S. X. Wei, Z. H. Wu, Z. X. Han, X. Q. Lu*, Investigation on CH3SH Desulfurization Mechanism at the Edge site of Co-doped MoS2 Cluster, Acta Chim. Sinica, 2018, 76, 62–67.
2017年
124. Y. Q. Lei, X. Q. Lu*. The decisive effect of interface states on the photocatalytic activity of the silver(I) oxide/titanium dioxide heterojunction, J. Colloid Interf. Sci., 2017, 492, 167–175.
123. C. Guo, S. X. Wei, S. N. Zhou, T. Zhang, Z. J. Wang,* S. P. Ng, X. Q. Lu*, C.-M. L. Wu, W. Y. Guo. Initial Reduction of CO2 on Pd-, Ru-, and Cu-Doped CeO2(111) Surfaces: Effects of Surface Modification on Catalytic Activity and Selectivity, ACS Appl. Mater. Interfaces, 2017, 9, 26107–26117.
122. M. Liu, X. Q. Lu, C. Guo, Z. J. Wang, Y. P. Li, Y. Lin, Y. Zhou, S. T. Wang, J. Zhang, Architecting mesoporous N-doped graphiticcarbon framework encapsulating CoTe2 as efficient oxygen evolution electrocatalyst, ACS Appl. Mater. Interfaces, 2017, 9, 36146–36153.
121. W. T. Wu, Q. G.Zhang, X. K.Wang, C. C. Han, X. D. Shao, Y. X. Wang, J. L. Liu, Z. T. Li, X. Q. Lu, M. B. Wu. Enhancing selective photooxidation through Co-Nx doped carbon materials as singlet oxygen photosensitizer, ACS Catal. 2017, 7267–7273.
120. X. Z. Liang, C. Wang, M. Wu, Y. Z Wu, F. Zhang, Z. X Han, X. Q. Lu, K. P Guo, Y. M. Zhao, Effects of core moiety and substitutedpositions in phenothiazine-based hole transporting materials towards high thermal stability and good hole mobility. Tetrahedron, 2017, 73, 7115–7121.
119. Y. Dang, L. M. Zhao, X. Q. Lu, J. Xu, P. P. Sang, S. Guo, H. Y. Zhu, W. Y. Guo. Molecular simulation of CO2/CH4 adsorption inbrown coal: Effect of oxygen-, nitrogen-, and sulfur-containing functional groups. Appl. Surf. Sci., 2017, 423, 33–42.
118. M. Liu, Z. J. Wang,* J. Liu, G. Wei, J. Du, Y. Li, C. H. An, J. Zhang. Synthesis of few-layer 1T[prime or minute]-MoTe2 ultrathin nanosheets for high-performance pseudocapacitors, J. Mater. Chem. A, 2017, 5, 1035–1042.
117. G. Wei, X. Xu, J. Liu, K. Du, J. Du, S. Zhang, C. H. An, J. Zhang, Z. J. Wang.* Carbon quantum dots decorated hierarchical Ni(OH)2 with lamellar structure for outstanding supercapacitor, Mater. Lett., 2017, 186, 131–134.
116. Y. Zhou, H. Xiao, S. Zhang, Y. Li, S. Wang, Z. J. Wang, C. H. An, J. Zhang. Interlayer expanded lamellar CoSe2 on carbon paper as highly efficient and stable overall water splitting electrodes, Electrochimica Acta, 2017, 241,106–115.
115. C. Li, J. Li, Z. J. Wang, S. Zhang, G. Wei, J. Zhang, H. Wang, C. H. An. The synthesis of hollow MoS2 nanospheres assembled by ultrathin nanosheets for an enhanced energy storage performance, Inorg. Chem. Front., 2017, 4, 309–314.
114. S. N. Zhou, C. Guo, Z. H. Wu, M. H. Wang, Z. J. Wang, S. X. Wei, S. R. Li, X. Q. Lu*. Edge-functionalized nanoporous carbons for high adsorption capacity and selectivity of CO2 over N2. Appl. Surf. Sci., 2017, 410, 259-266.
113. Z. Q. Wang, Y. Q. Miao, H. X. Xu, X. Z. Liang, K. X. Wang, R. Q. Zhang, K. Li, X. Q. Lu, H. Wang, Tetra-carbazole substituted spiro[fluorene-9,9‘-xanthene]-based hole-transporting materials with high thermal stability and mobility for efficient OLEDs. Dyes and Pigments, 2017, 139, 764-771.
112. J. Cheng, Y. X. Cao, X. Z. Liang; J. X. Zheng, F. Zhang, S. X. Wei, X. Q. Lu, S. H. Yang. Dithiafulvene-based organic sensitizers using pyridine as the acceptor for dye-sensitized solar cells.Mater. Chem. Phys., 2017, 192. 349–355.
111. S.-P. Ng, G. Y. Qiu, N. Ding, X. Q. Lu, C.-M. L. Wu. Label-free detection of 3-nitro-l-tyrosine with nickel-doped graphene localized surface plasmon resonance biosensor.Biosens. Bioelectron., 2017, 89, 468–476.
110. J. Cheng, F. Zhang, K. Li, J. Li, X. Q. Lu, J. X. Zheng, K. P. Guo, S. H. Yang, Q. C. Dong. A planar dithiafulvene based sensitizer forming J-aggregates on TiO2 photoanode to enhance the performance of dye-sensitized solar cells. Dyes Pigments, 2017, 136, 97–103.
109. Y. H. Guo, X. Q. Lu, G. X. Li, L. M. Zhao, S. X. Wei, W. Y. Guo. Theoretical design of push-pull porphyrin dyes with π-bridge modification for dye-sensitized solar cells, J. Photoch. and Photobio. A: Chem., 2017, 332, 232–240.
2016年
108. Z. J. Wang, S. Wang, J. Liu, W. Jiang, Y. Zhou, C. An, J. Zhang. Synthesis of AgInS2-xAg2S-yZnS-zIn6S7 (x, y, z = 0, or 1) Nanocomposites with Composition-Dependent Activity towards Solar Hydrogen Evolution, Materials, 2016, 9, 329.
107. Y. Zhou, H. Xiao, S. Wang, X. Pan, Z. J. Wang, C. H. An, J. Zhang. Synthesis of layer-expanded MoS2 nanosheets/carbon fibers nanocomposites for electrochemical hydrogen evolution reaction, Mater. Chem. Phys., 2016, 183, 18–23.
106. X. Zhao, G. Wei, J. Liu, Z. J. Wang, C. H. An, J. Zhang. Synthesis of heterostructured Pd@TiO2/TiOF2 nanohybrids with enhanced photocatalytic performance, Mater. Res. Bull., 2016, 80, 337–343.
105. H. Xiao, S. Wang, C. Wang, Y. Li, H. Zhang, Z. J. Wang, Y. Zhou, C. H. An, J. Zhang. Lamellar structured CoSe2 nanosheets directly arrayed on Ti plate as an efficient electrochemical catalyst for hydrogen evolution, Electrochimica Acta, 2016, 217, 156–162.
104. X. Q. Lu*, Z. G. Zhao, K. Li, Z. X. Han, S. X. Wei, C. Guo, S. N. Zhou, Z. H. Wu, W. Y. Guo, C.-M. L. Wu. First-principles insight into photoelectronic properties of Ge-based perovskites, RSC Adv., 2016, 6, 86976–86981.
103. X. Q. Lu*, Y. Shao, K. Li, Z. G. Zhao, S. X. Wei, W. Y. Guo. Role of functionalized acceptors in heteroleptic bipyridyl Cu(I) complexes for dye-sensitized solar cells. Electron. Mater. Lett., 2016, 12, 589–595.
102. X. Q. Lu*, Z. G. Deng, C. Guo, W. L. Wang, S. X. Wei, S.-P. Ng, X. F. Chen, N. Ding, W. Y. Guo, C.-M. L. Wu. Methanol oxidation on Pt3Sn(111) for direct methanol fuel cells: methanol decomposition. ACS Appl. Mater. Interfaces, 2016, 8, 12194–12204.
101. X. Q. Lu*, Z. G. Zhao, K. Li, S. X. Wei, Y. Y. Qu, Y. Q. Niu, X. F. Liu. First-principles investigation on structural and photoelectronic properties of mixed perovskites CH3NH3PbxSn1-xI3.Acta Phys. -Chim. Sin., 2016, 32, 1439–1445.
100. X. Q. Lu*, W. L. Wang, Z. G. Deng, H. Y. Zhu, S. X. Wei, S.-P. Ng, W. Y. Guo, C.-M. L. Wu. Methanol oxidation on Ru(0001) for direct methanol fuel cell: Analysis of competitive reaction mechanism. RSC Adv., 2016, 6, 1729–1737.
99. Y. Q. Lei, X. Q. Lu*. Reversing the photocatalytic activity orders of anatase TiO2 facets by surface treatment,ChemistrySelect, 2016, 1, 5838–5841.
98. Z. G. Zhao, X. Q. Lu*, K. Li, S. X. Wei, X. F. Liu, K. Niu, W. Y. Guo. First-Principles Theory Investigation on Structural and Photoelectronic Properties of Perovskites: Trigonal versus Hexagonal HC(NH2)2PbI3. Acta Chim. Sinica, 2016, 74, 1003–1008.
97. S. N. Zhou,X. Q. Lu*, Z. H. Wu, D. L Jin, C. Guo, M. H. Wang; S. X.Wei. Diffusion and separation of CH4/N2 in pillared graphene nanomaterials: a molecular dynamics investigation, Chem. Phys. Lett., 2016, 660, 272–276.
96. Z. G. Zhao, Y. Q. Niu, Y. Zhao, Q. H. Song, L. Xin, X. Q. Lu*, First-principles theory investigation on structural and photoelectronic properties of formamidinium lead halide perovskites. Acta Chim. Sinica, 2016, 74, 689–693.
95. S. X. Wei, Y. Shao, X. F. Shi, X. Q. Lu*, K. Li, Z. G. Zhao, C. Guo, H. Y. Zhu, W. Y. Guo. Heteroleptic Cu(I) complexes integrating functionalized chromophores for dye-sensitized solar cells: an in-depth analysis of electronic structure, spectrum, excitation, and intramolecular electron transfer. Org. Electron., 2016, 29, 142–150.
94. S. X. Wei, K. Li, X. Q. Lu*, Z. G. Zhao, Y. Shao, Y. Dang, S. R. Li, W. Y. Guo. Theoretical insight into electronic structure and optoelectronic properties ofheteroleptic Cu(I)-based complexes for dye-sensitized solar cells. Mater. Chem. Phys., 2016, 173,139–145.
93. S. R. Li, X. Q. Lu*, H. Y. Zhu, W. Y. Guo. Mechanism of C-N Bond Cleavage in Aniline on MoP(001) Surface. Acta Phys. -Chim. Sin. 2016, 32, 465–473.
92. G. X. Li, H. Y. Zhu, L. M. Zhao, W. Y. Guo, H. F. Ma, Y. C. Yu, X. Q. Lu, Y. J. Liu, Thiophene hydrodesulfurization on clean and sulfur covered MoP(001): Theoretical survey of the positive effect of sulfur deposition on the catalytic performance. J. Phys. Chem. C., 2016, 120, 23009–23023.
91. J. H. Hu, W. Y. Guo, X. Q. Lu, H. Y. Zhu, F. Shi, J. Q. Yan, R. B. Jiang. Unraveling the mechanism of the Zn-improved catalytic activity of Pd-based catalysts for water-gas shift reaction, J. Phys. Chem. C., 2016, 120, 20181–20191.
90. Y. J. Liu, W. Y. Guo, X. Q. Lu, W. Gao, G. X. Li, Y. H. Guo, J. Zhu, L. Z. Hao. Density functional theory study of hydrogenation of S to H2S on Pt–Pd alloy surfaces. RSC Adv., 2016, 6, 6289–6299.
89. Y. H. Chi, L. M. Zhao, X. Q. Lu, C. H. An, W. Y. Guo, C.-M. L. Wu.Effect of Alloying on the Stabilities and Catalytic properties of Ag-Au Bimetallic Subnanoclusters: A Theoretical Investigation. J. Mater. Sci., 2016, 51, 5046–5060.
88. Y. H. Chi, L. M. Zhao, X. Q. Lu, C. H. An, W. Y. Guo, C.-M. L. Wu. Effect of Alloying on the Stabilities and Catalytic properties of Pt-Au Bimetallic Subnanoclusters: A Theoretical Investigation.J. Nanopart. Res., 2016, 18, 1–12.
2015年
87. Z. J. Wang, S. Liu, T. Jiang, X. Xu, J. Zhang, C. H. An, C. Wang. N-type SnO2 nanosheets standing on p-type carbon nanofibers: a novel hierarchical nanostructures based hydrogen sensor, RSC Adv., 2015, 5, 64582–64587.
86. G. J. Wu, Z. J. Wang, X. X. Zhang, J. Feng, S. T. Wang, J. Zhang, C. H. An. A facile approach to fabricate superhydrophobic and corrosion resistant surface, Mater. Res. Express, 2015, 2, 015501.
85. X. Q. Lu, D. L. Jin, S. X. Wei, Z. J. Wang, C. H. An, W. Y. Guo. Strategies to enhance CO2 capture and separation based on the engineering adsorbent materials. J. Mater. Chem. A, 2015, 3, 12118–12132.
84. X. Q. Lu*, D. L. Jin, S. X. Wei, M. M. Zhang, Q. Zhu, X. F. Shi, Z. G. Deng, W. Y. Guo, W. Z. Shen. Competitive adsorption of binary CO2-CH4 mixture in nanoporous carbons: effect of edge-functionalization. Nanoscale, 2015, 7, 1002–1012.
83. X. Q. Lu*, Y. Shao, S. X. Wei, Z. G. Zhao, K. Li, C. Guo, W. L. Wang, M. M. Zhang, W. Y. Guo.Effect of functionalized π-bridge on porphyrin sensitizers for dye-sensitized solar cells: an in-depth analysis of electronic structure, spectrum, excitation, and intramolecular electron transfer. J. Mater. Chem. C, 2015, 3, 10129–10139.
82. X. Q. Lu*, Z. G. Deng, S. X. Wei, Q. Zhu, W. L. Wang, W. Y. Guo, C.-M. L. Wu. CO tolerance of Pt3Sn(111) catalystin ethanol decomposition.Catal. Sci. Technol., 2015, 5, 3246–3258.
81. X. Q. Lu*, M. M. Zhang, D. L. Jin, Y. Dang, S. N. Zhou, S. X. Wei, H. Y. Zhu, L. M. Zhao. Competitive adsorption of CO2/CH4 in porous boron nitride nanometerials.Mater. Lett., 2015, 161, 545–548.
80. X. Q. Lu*, W. L. Wang, S. X. Wei,C. Guo, Y. Shao, M. M. Zhang, Z. G. Deng, H. Y. Zhu, W. Y. Guo.Initial reduction of CO2 on perfect and O-defective CeO2(111) surfaces: towards CO or COOH? RSC Adv., 2015, 5, 97528–97535.
79. Z. G. Deng, Y. Q. Lei,X. Q. Lu*, W. L. Wang, H. Y. Zhu,S.-P. Ng, W. Y. Guo,C.-M. L. Wu.Hydrodenitrogenation of pyridine on MoP(010): Competition between hydrogenation and denitrification. Inorg. Chim. Acta, 2015, 435, 30–37.
78. Y. Shao,X. Q. Lu*, K. Li, Z. G. Zhao, X. F. Shi, D. L. Jin, H. Y. Zhu, G. W. Yang, W. Y. Guo. Theoretical insight into photo-induced intramolecular electron transfer in heterodinuclear Ru(II)−Co(III) complexes. Mater. Chem. Phys., 2015, 162, 6–10.
77. K. P. Guo, Z. X. Gao, J. Cheng, Y. Shao,X. Q. Lu*, H. Wang. Linear thiophene-containing π-conjugated aldehydes with aggregation-induced emissioin for building solid red luminophors. Dyes pigments, 2015, 115, 166–171.
76. S. X. Wei, X. F. Shi, X. Q. Lu*, Y. Shao, D. L. Jin, Z. G. Deng, Z. G. Zhao, K. Li, W. Y. Guo. Cu(I)-based sensitizers featuring 6,6′-dimethyl-4,4′-dicarboxylate-2,2′-bipyridine with functionalized 2,9-dimethyl-1,10-phenanthroline ligands: A structural, electronic and spectral investigation. Sci. Adv. Mater., 2015, 7, 1361–1367.
75. L. M. Zhao, S. P. Wang, Q. Y. Ding, W. B. Xu, P. P. Sang, Y. H. Chi, X. Q. Lu, W. Y. Guo. The oxidation of methanol on PtRu(111): A periodic density functional theory investigation. J. Phys. Chem. C, 2015, 119, 20389–20400.
74. Y. H. Chi, L. M. Zhao, X. Q. Lu, C. H. An, W. Y. Guo, Y. Q Liu, C.-M. L. Wu. Effects of subnanometer silver clusters on the AgBr(110) photocatalyst surface: a theoretical investigation. Catal. Sci. Technol. 2015,5, 4821–4829.
73. L. M. Zhao, Q. Y. Ding, W. B. Xu, P. P. Sang, X. L. He, Z. M. Shi, Y. H. Chi, X. Q. Lu, W. Y. Guo. The ligand effect on the selective C–H versus C–C bond activationof propane by NiBr+: a theoretical study. Theor. Chem. Acc. 2015, 134, 1–13.
72. H. F. Wang, L. M. Zhao, W. B. Xu, S. P. Wang, Q. Y. Ding, X. Q. Lu, W. Y. Guo. The properties of the bonding between CO and ZIF‑8 structures: a density functional theory study. Theor. Chem. Acc. 2015, 134, 1–9.
2014年
71. C. H. An, J. Liu, S. Wang, J. Zhang, Z. J. Wang, R. Long, Y. Sun. Concaving AgI sub-microparticles for enhancedphotocatalysis, Nano Energy, 2014, 9, 204–211.
70. J. Feng, J. Liu, G. Wei, J. Zhang, S. Wang, Z. J. Wang, C. H. An. Solar-driven Pt modified hollow structured CdS photocatalyst for efficient hydrogen evolution, RSC Adv., 2014, 4, 36665–36670.
69. D. L. Jin,X. Q. Lu*, M. M. Zhang, S. X. Wei, Q. Zhu, X. F. Shi, Y. Shao, W. L. Wang, W. Y. Guo. Adsorption behaviour of CH4 on microporous carbons: Effect of surface heterogeneity. Phys. Chem. Chem. Phys., 2014, 16, 11037–11046.
68. Z. G. Deng,X. Q. Lu*, Z. Q. Wen, S. X. Wei,Q. Zhu, D. L. Jin, X. F. Shi, W. Y. Guo. Decomposition mechanism of methylamine to hydrogen cyanide on Pt(111): Selectivity of the C–H, N–H and C–N bond scissions. RSC Adv., 2014, 4, 12266–12274.
67. S. X. Wei,X. Q. Lu*, X. F. Shi, Z. G. Deng, Y. Shao, L. M. Zhao, W. Y. Guo, C.-M. L. Wu, Theoretical insight into organic dyes incorporating triphenylamine-based donors and binary π-conjugated bridges for dye-sensitized solar cells. Int. J. Photoenergy, 2014, art. no. 280196.
66. X. F. Shi,X. Q. Lu*, Y. Shao, S. X. Wei, Q. Zhu, D. L. Jin, Z. G. Deng, W. Y. Guo.Theoretical investigation on novel porphyrin dyes with functionalized bridge and donor groups for dye-sensitized solar cells.Sci. Adv. Mater., 2014, 6, 2595–2602.
65. S.-P. Ng, X. Q. Lu, N. Ding, C.-M. L. Wu, C.-S. Lee. Plasmonic enhanced dye-sensitized solar cells with self-assembly gold-TiO2@core–shell nanoislands. Solar Energy, 2014, 99, 115–125.
64. K. P. Guo, J. L. Yang, X. F. Shi, X. Q. Lu, J. Cheng, Y. L. Wu, Y. Guo, H. Wang, Aπ-extended tetrathiafulvene derivative: Synthesis and photoluminescence properties. Mater. Chem. Phys., 2014,146, 193–197.
63. Y. H. Chi, L. M. Zhao, X. Q. Lu, W. Y. Guo, Y. Q. Liu, C.-M. L. Wu. Effects of atomic Ag on photocatalyst AgBr surfaces: A theoretical survey. RSC Adv., 2014, 4, 33134–33143.
62. H. Jiang, W. Wang, C. Zhang, X. N. Hu, G. H. Zhong, X. Q. Lu, Y. H. Su. Phase transitions of actinium dihydride: Pressure-induced charge transfer driving effect. Int. J. Hydrogen Energy, 2014, 15827–15835.
61. C. C. Miao, G. W. Yang, Z. H. Bu, X. Q. Lu, L. M. Zhao, W. Y. Guo, Q. Z. Xue. Preparation of large diameter and low density ZnS microtube arrays via a sacrificial template method. Mater. Lett., 2014, 115, 140–143.
2013年
60. Z. J. Wang, Z. Y. Li, T. Jiang, X. Xu, C. Wang. Ultrasensitive Hydrogen Sensor Based on Pd0-Loaded SnO2 Electrospun Nanofibers at Room Temperature, ACS Appl. Mater. Inter., 2013, 5, 2013–2021.
59. Z. J. Wang, Z. Y. Li, X. Xu, T. Jiang, H. Zhang, W. Wang, C. Wang. One-dimensional isomeric and hierarchical TiO2 nanostructures: novel air stable semiconducting building blocks, J. Mater. Chem. C, 2013, 1, 213–215.
58. T. Jiang, Z. J. Wang, Z. Y. Li, W. Wang, X. Xu, X. Liu, J. Wang, C. Wang. Synergic effect within n-type inorganic-p-type organic nano-hybrids in gas sensors, J. Mater. Chem. C, 2013, 1, 3017–3025.
57. Y. Tong, Z. Li, X. Lu, L. Yang, W. Sun, G. Nie, Z. Wang, C. Wang. Electrochemical determination of dopamine based on electrospun CeO2/Au composite nanofibers, Electrochimica Acta, 2013, 95, 12–17.
56.X. Q. Lu*, Z. G. Deng, K.-S. Chau, L. F. Li, Z. Q. Wen, W. Y. Guo, C.-M. L. Wu. Mechanistic insight into catalytic oxidation of ammonia on clean, O- and OH-assisted Ir(1 1 1) surfaces. ChemCatChem, 2013, 5, 1832–1841.
55. X. Q. Lu, K-S. Chau, S. X. Wei,Z. G. Deng, N. Ding, L. M. Zhao, C.-M. L. Wu, W. Y. Guo. Theoretical insight into the spectral characteristics of Fe(II)-based complexes for dye-sensitized solar cells: Functionalized bipyridyl chromophores. J. Organomet. Chem., 2013, 741-742, 168–175.
54. Z. G. Deng,X. Q. Lu*, Z. Q. Wen, S. X. Wei, Y. J. Liu, D. L. Fu, L. M. Zhao, W. Y. Guo. Mechanistic insight into the hydrazine decomposition on Rh(111): Effect of reaction intermediate on catalytic activity. Phys. Chem. Chem. Phys., 2013, 15, 16172–16182.
53. W. Y. Guo, M. Li,X. Q. Lu*, H. Y. Zhu, Y. Li, S. R. Li, L. M. Zhao. Ethanol decomposition on a Pd(110) surface: a density functional theory investigation. Dalton Trans., 2013, 42, 2309–2318.
52. F. Y. Zhang, L. M. Zhao, H. G. Sui, X. Q. Lu, G. W. Yang, Y. H. Guo, W. Y. Guo, Q. T. Fu. Reactivity of ethanol with ground state Ni+(2D) in the gas phase: A density functional study. Comput. Theor. Chem., 2013, 1023, 29–37.
51. L. M. Zhao, M. Tan, J. Chen, Q. Y. Ding, X. Q. Lu, Y. H. Chi, G. W. Yang, W. Y. Guo, Q. T. Fu. The Competitive O−H versus C−H bond activation of ethanol and methanol by VO2+ in gas-phase: A DFT study. J. Phys. Chem. A, 2013, 117, 5161–5170.
50. J. Chen, L. Y. Jia, L. M. Zhao,X. Q. Lu, W. Y. Guo, J. J. Weng, F. Qi. Analysis of petroleum aromatics by laser-induced acoustic desorption/tunable synchrotron vacuum ultraviolet photoionization mass spectrometry. Energy Fuels, 2013, 27, 2010–2017.
2012年
49. D. Vu, Z. Y. Li, H. N. Zhang, W. Wang, Z. J. Wang, X. R. Xu, B. Dong, Ce Wang. Adsorption of Cu(II) fromAqueous Solution by Anatase Mesoporous TiO2 Nanofibers Prepared Via Electrospinning. J. Colloid Interface Sci., 2012, 367, 429-435.
48.X. Q. Lu*, L. Liu, Y. Li, W. Y. Guo, L. M. Zhao, H. H. Shan. Theoretical analysis of conversion mechanism of acetylene to ethylidyne on Pt(111).Phys. Chem. Chem. Phys., 2012, 14 (16), 5642–5650.
47. H. Y. Zhu,X. Q. Lu*, W. Y. Guo, L. F. Li, L. M. Zhao, H. H. Shan. Theoretical insight into the desulfurization of thiophene on Pt(110): A density functional investigation. J. Mol. Catal. A Chem., 2012, 363–364, 18–25.
46. S. R. Li,X. Q. Lu*,W. Y. Guo, H. Y. Zhu, M. Li, L. M. Zhao, Y. Li, H. H. Shan. Formaldehyde oxidation on the Pt/TiO2(101) surface: A DFT investigation. J. Organomet. Chem., 2012, 704, 38–48.
45. K. P. Guo, K. Y. Yan, X. Q. Lu, Y. C. Qiu, Z. K. Liu, J. W. Sun, F. Yan, W. Y. Guo, S. H. Yang. Dithiafulvenyl unit as a new donor for high-efficiency dye-sensitized solar cells: Synthesis and demonstration of a family of metal-free organic sensitizers. Org. Lett., 2012, 14, 2214–2217.
44. L. M. Zhao,X. Q. Lu, Y. Y. Li, J. Chen, W. Y. Guo. On the gas-phase Co+-mediated oxidation of ethane by N2O: A mechanistic study. J. Phys. Chem. A, 2012, 116(12), 3282–3289.
43. N. Ding, X. F. Chen, C.-M. L. Wu., X. Q. Lu. Computational investigation on the effect of graphene oxide sheets as nanofillers in poly(vinyl alcohol)/graphene oxide composites. J. Phys. Chem. C, 2012, 116, 22532–22538.
42. N. Ding, X. Q. Lu, C.-M. L. Wu. Nitrated tyrosine adsorption on metal-doped graphene: A DFT study. Comp. Mater. Sci., 2012, 51, 141–145.
41. X. F. Chen, H. Zang, X. Wang, J.-G. Cheng, R.-S. Zhao, C.-G. Cheng, X. Q. Lu. Metal-organic framework MIL-53(Al) as a solid-phase microextraction adsorbent for the determination of 16 polycyclic aromatic hydrocarbons in water samples by gas chromatography-tandem mass spectrometry. Analyst, 2012, 137, 5411–5419.
40. X. F. Chen, H. Zang, H.-S. Yeung, X. Q. Lu, T.-W. D.Chan. Reaction pathways of Sc+ (3D,1D) and Fe+ (6D, 4F) with acetone in the gas phase: metal ion oxidation and acetone deethanization. J. Mass Spectrom., 2012, 47, 1518–1525.
39. Y. Li, W. Y. Guo, H. Y. Zhu, L. M. Zhao, S. R. Li, D. L. Fu, X. Q. Lu, H. H. Shan. Initial hydrogenations of pyridine on MoP(001): A density functional study. Langmuir, 2012, 28, 3129–3137.
2011年
38. W. Wang, Z. Y. Li*, X. R. Xu, B. Dong, H. N. Zhang, Z. J. Wang, C. Wang, R. H. Baughman, S. L. Fang. Au-Doped Polyacrylonitrile-Polyaniline Core-Shell Electrospun Nanofibers Having High Field-Effect Mobilities, Small, 2011, 7, 597–600.
37. Y. Li, Z. L. Li, X. F. Lu, C. C. Zhang, Z. J. Wang, L. R. Kong, C. Wang, X. C. Liu. Composite membranes based on sulfonated poly(aryl ether ketone)s containing the hexafluoroisopropylidene diphenyl moiety and poly(amic acid) for proton exchange membrane fuel cell application, Int. J. Hydrogen Energy, 2011, 36, 14622–14631.
36. W. Wang, X. F. Lu, Z. Y. Li, J. Y. Lei, X. C. Liu, Z. J. Wang, H. N. Zhang, C. Wang. One-Dimensional Polyelectrolyte/Polymeric Semiconductor Core/Shell Structure: Sulfonated Poly(arylene ether ketone)/Polyaniline Nanofibers for Organic Field-Effect Transistors, Adv. Mater., 2011, 23, 5109–5112.
35. X. R. Xu, J. H. Sun, H. N. Zhang, Z. J. Wang, B. Dong, T. T. Jiang, W. Wang, Z. Y. Li, C. Wang. Effects of Al doping on SnO2 nanofibers in hydrogen sensor, Sen. Actuators, B, 2011, 160, 858–863.
34. X. Q. Lu, S. X. Wei, C.-M. L. Wu, S. R. Li, W. Y. Guo. Can polypyridyl Cu(I)-based complexes provide promising sensitizers for dye-sensitized solar cells? A theoretical insight into Cu(I) versus Ru(II) sensitizers. J. Phys. Chem. C, 2011, 115, 3753–3761.
33. X. Q. Lu, S. X. Wei, C.-M. L. Wu, W. Y. Guo, L. M. Zhao. Theoretical characterization of ruthenium complexes containing functionalized bithiophene ligands for dye-sensitized solar cells.J. Organomet. Chem., 2011, 696, 1632–1639.
32. X. Q. Lu, S. X. Wei, C.-M. L. Wu, N. Ding, S. R. Li, L. M. Zhao, W. Y. Guo. Theoretical insight into the spectral characteristics of Fe(II)-based complexes for dye-sensitized solar cells. Part I: Polypyridyl ancillary ligands. Int. J. Photoenergy, 2011, art. no. 316952.
31. Y. Y. Li, W. Y. Guo, L. M. Zhao, Z. C. Liu, X. Q. Lu,H. H. Shan. Theoretical investigation of the reaction of Mn+ with ethylene oxide. J. Phys. Chem. A, 2011, 116, 512–519.
30. R. B. Jiang, W. Y. Guo, M. Li, H. Y. Zhu, L. M. Zhao, X. Q. Lu, H. H. Shan. Methanol dehydrogenation on Rh(1 1 1): a density functional and microkinetic modeling study. J. Mol Catal. A: Chem., 2011, 344, 99–110.
29. H. Y. Zhu, W. Y. Guo, M. Li, L. M. Zhao, S. R. Li, Y. Li, X. Q. Lu, H. H. Shan. Adsorption and desulfurization of thiophene and its hydrogenated derivatives on Pt(111): implication for the mechanism of hydrodesulfurization over noble metal catalysts. ACS Catal., 2011, 1, 1498–1510.
28. L. M. Zhao, W. Y. Guo, Z. C. Liu, Y. Y. Li, X. Q. Lu.Theoretical study of the gas-phase Fe+-mediated oxidation of ethane by N2O.Theor. Chem. Acc., 2011, 128, 349–358.
2010年及以前
27. Z. J. Wang, Z. Y. Li, H. N. Zhang, W. Wang, C. Wang. Improved Hydrogen Monitoring Properties Based on p-NiO/n-SnO2 Heterojunction Composite Nanofibers, J. Phys. Chem. C, 2010, 114, 6100–6105.
26. Z. J. Wang, Z. Y. Li, L. Liu, X. R. Xu, H. N. Zhang, W. Wang, W. Zheng, C. Wang. A novel alcohol detector based on ZrO2-doped SnO2 electrospun nanofiber, J. Am. Ceram. Soc., 2010, 93, 634–637.
25. W. Zheng, X. F. Lu, W. Wang, B. Dong, H. N. Zhang, Z. J. Wang, X. R. Xu, C. Wang. A Rapidly Responding Sensor for Methanol Based on Electrospun In2O3–SnO2 Nanofibers, J. Am. Ceram. Soc., 2010, 93, 15–17.
24. H. N. Zhang, Z. Y. Li, L. Liu, X. R. Xu, Z. J. Wang, W. Wang, W. Zheng, C. Wang. Enhancement of hydrogen monitoring properties based on Pd-SnO2 composite nanofibers, Sen. Actuators, B, 2010, 147, 111–115.
23. W. Zheng, X. F. Lu, W. Wang, Z. J. Wang, M. X. Song, Y. Wang, C. Wang. Fabrication of novel Ag nanowires/poly (vinylidene fluoride) nanocomposite film with high dielectric constant, Physica Atatus Solidi (a), 2010, 207, 1870–1873.
22. Z. J. Wang, Z. Y. Li, H. N. Zhang, C. Wang. Improved photocatalytic activity of mesoporous ZnO-SnO2 coupled nanofibers，Catal. Commun., 2009, 11, 257–260.
21. X. F. Song，Z. J. Wang, Y. B. Liu, C. Wang, L. J. Li. A highly sensitive ethanol sensor based on mesoporous ZnO-SnO2 nanofibers, Nanotechnology, 2009, 20, 075501.
20. W. Wang, Z. Y. Li, L. Liu, H. N. Zhang, W. Zheng, Y. Wang, H. M. Huang, Z. J. Wang, C. Wang. Humidity sensor based on LiCl-doped ZnO electrospun nanofibers, Sen. Actuators, B, 2009, 141, 404–409.
19. W. Zheng, X. F. Lu, W. Wang, Z. Y. Li, H. N. Zhang, Y.u Wang, Z. J. Wang, C. Wang. A highly sensitive and fast-responding sensor based on electrospun In2O3 nanofibers, Sen. Actuators, B, 2009, 142, 61–65.
18. X. F. Song, Z. J. Wang, Z. Y. Li, C. Wang. Ultrafine porous carbon fibers for SO2 adsorption via electrospinning of polyacrylonitrile solution, J Colloid Interface Sci., 2008, 327, 388–392.
17. X. Q. Lu, S. X. Wei, W. Y. Guo, C.-M. L. Wu. Mechanistic insight into the gas-phase reactions of methylamine with ground state Co+(3F) and Ni+(2D). J. Phys. Chem. A, 2010, 114, 12490–12497.
16. X. Q. Lu, C.-M. L. Wu, S. X. Wei, W. Y. Guo. DFT/TD-DFT investigation of electronic structures and spectra properties of Cu-based dye sensitizers. J. Phys. Chem. A, 2010, 114, 1178–1184.
15. X. Q. Lu, W. Y. Guo, T. F. Yang, L. M. Zhao, S. C. Du, L. Wang, H. H. Shan. Gas-phase reactions of Co+ with ethylamine: A theoretical approach to the reaction mechanisms of transition metal ions with primary amines. J. Phys. Chem. A, 2008, 112, 5312–5321.
14. X. Q. Lu, W. Y. Guo, L. M. Zhao, X. F. Chen, Q. T. Fu, Y. Ma. Hydride abstraction of methylamine with Cu+(1S) in the gas phase: A density functional theory study.J. Organomet. Chem., 2007, 692, 3796–3803.
13. R. B. Jiang, W. Y. Guo, M. Li, X. Q. Lu, J. Y. Yuan, H. H. Shan. Dehydrogenation of methanol on Pd(100): comparison with the results of Pd(111). Phys. Chem. Chem. Phys., 2010, 12, 7794–7803.
12. M. Li, W. Y. Guo, R. B. Jiang, L. M. Zhao, X. Q. Lu, H. Y. Zhu, D. L. Fu, H. H. Shan. Mechanism of the ethylene conversion to ethylidyne on Rh(111): a density functional investigation. J. Phys. Chem. C, 2010, 114, 8440–8448.
11. M. Li, W. Y. Guo, R. B. Jiang, L. M. Zhao, X. Q. Lu, H. Y. Zhu, D. L. Fu, H. H. Shan. Density functional study of ethanol decomposition on Rh(111). J. Phys. Chem. C, 2010, 114, 21493–21503.
10. H. Y. Zhu, W. Y. Guo, R. B. Jiang, L. M. Zhao, X. Q. Lu, M. Li,D. L. Fu, H. H. Shan.Decomposition of methanthiol on Pt(111): a density functional investigation. Langmuir, 2010, 26, 12017–12025.
9. L. M. Zhao, Y. Wang, W. Y. Guo, H. H. Shan, X. Q. Lu, T. F. Yang. Theoretical investigation of the Fe+-catalyzed oxidation of acetylene by N2O. J. Phys. Chem. A, 2008, 112, 5676–5683.
8. L. M. Zhao, Z. C. Liu, W. Y. Guo, X. Q. Lu, X. Q. Lin, H. H. Shan. Mechanisms for the Ni+-mediated oxidation of benzene to phenol by N2O. Chem. Phys. Lett., 2008, 463, 54–59.
7. L. M. Zhao, W. Y. Guo, T. F. Yang, X. Q. Lu. Theoretical survey of the potential energy surface of methyl nitrite + Cu+ reaction. J. Phys. Chem. A, 2007, 112, 533–541.
6. W. Y. Guo, T. Yuan, X. F. Chen, L. M. Zhao, X. Q. Lu, S. J. Wu. Theoretical investigation of C-H activation in Mg+-CH3X (X=H, NH2 and CHO). J. Mol. Struct. – Theochem., 2006, 764, 177–186.
5. L. M. Zhao, R. R. Zhang, W. Y. Guo, X. Q. Lu. The oxidation pathways of Ti+ by acetaldehyde in the gas phase: a density functional theory investigation. Chem. Phys. Lett., 2006, 431, 56–61.
4. L. M. Zhao, R. R. Zhang, W. Y. Guo, S. J. Wu, X. Q. Lu. Theoretical investigation of the decarbonylation of acetaldehyde by Fe+ and Cr+. ChemPhysChem,2006, 7, 1345–1354.
3. H. C. Liu, Y. H. Hu, S. H. Yang, W. Y. Guo, X. Q. Lu, L. M. Zhao. Experimental and computational studies of intracomplex reactions in Mg+ (primary, secondary alkylamine) complexes induced by photoexcitation of Mg+. Chem. Eur. J., 2005, 11, 6392–6406.
2. L. M. Zhao, R. R. Zhang, W. Y. Guo, S. J. Wu, X. Q. Lu. Does the Co+-assisted decarbonylation of acetaldehyde occur via C–C or C–H activation? A theoretical investigation using density functional theory. Chem. Phys. Lett., 2005, 414, 28–33.
1. W. Y. Guo, X. Q. Lu, S. Q. Hu, S. H. Yang. Ab initio study of hydride abstraction reaction in the Mg+-NH2CH3 complex. Chem. Phys. Lett., 2003, 381, 109–116.
