| Year |
Citation |
Score |
| 2021 |
Jian M, Liu JX, Li WX. Hydroxyl improving the activity, selectivity and stability of supported Ni single atoms for selective semi-hydrogenation. Chemical Science. 12: 10290-10298. PMID 34377416 DOI: 10.1039/d1sc03087f |
0.325 |
|
| 2020 |
Jian M, Zhao C, Li WX. Ligand Stabilized Ni Catalyst for Efficient CO Oxidation. Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry. PMID 33063907 DOI: 10.1002/cphc.202000730 |
0.315 |
|
| 2020 |
Dionigi F, Zeng Z, Sinev I, Merzdorf T, Deshpande S, Lopez MB, Kunze S, Zegkinoglou I, Sarodnik H, Fan D, Bergmann A, Drnec J, Araujo JF, Gliech M, Teschner D, ... ... Li WX, et al. In-situ structure and catalytic mechanism of NiFe and CoFe layered double hydroxides during oxygen evolution. Nature Communications. 11: 2522. PMID 32433529 DOI: 10.1038/S41467-020-16237-1 |
0.371 |
|
| 2020 |
Luo L, Wang M, Cui Y, Chen Z, Wu J, Cao Y, Luo J, Dai Y, Li WX, Bao J, Zeng J. Surface Iron Species in a Palladium-Iron Intermetallic Promote and Stabilize CO2 Methanation. Angewandte Chemie (International Ed. in English). PMID 32259391 DOI: 10.1002/Anie.201916032 |
0.372 |
|
| 2020 |
Cao Y, Luo J, Huang W, Ling Y, Zhu J, Li WX, Yang F, Bao X. Probing surface defects of ZnO using formaldehyde. The Journal of Chemical Physics. 152: 074714. PMID 32087658 DOI: 10.1063/1.5138372 |
0.414 |
|
| 2020 |
Su H, Yu C, Liu J, Zhao Y, Ma X, Luo J, Sun C, Li W, Sun K. CO Activation and Methanation Mechanism on Hexagonal Close-packed Co Catalysts: Effect of Functionals, Carbon Deposition and Surface Structure Catalysis Science & Technology. 10: 3387-3398. DOI: 10.1039/D0Cy00499E |
0.426 |
|
| 2020 |
Lin H, Liu J, Fan H, Li W. Compensation Between Surface Energy and HCP/FCC Phase Energy of Late Transition Metals from First-Principles Calculations Journal of Physical Chemistry C. 124: 11005-11014. DOI: 10.1021/Acs.Jpcc.0C02142 |
0.324 |
|
| 2019 |
Zhu J, Hu S, Zeng Z, Li WX. First-principles investigation of electrochemical dissolution of Pt nanoparticles and kinetic simulation. The Journal of Chemical Physics. 151: 234711. PMID 31864240 DOI: 10.1063/1.5129631 |
0.305 |
|
| 2019 |
Yao Y, Gu XK, He D, Li Z, Liu W, Xu Q, Yao T, Lin Y, Wang HJ, Zhao C, Wang X, Yin P, Li H, Hong X, Wei S, ... Li WX, et al. Engineering Electronic Structure of Sub-monolayer Pt on Intermetallic Pd3Pb via Charge Transfer Boosts Hydrogen Evolution Reaction. Journal of the American Chemical Society. PMID 31804817 DOI: 10.1021/Jacs.9B09391 |
0.37 |
|
| 2019 |
Wang H, Zhao X, Huang C, Jin X, Wei D, Dai D, Ma Z, Li WX, Yang X. Adsorption Features of Formaldehyde on TiO(110) Surface Probed by High-Resolution Scanning Tunnelling Microscopy. The Journal of Physical Chemistry Letters. 3352-3358. PMID 31181938 DOI: 10.1021/Acs.Jpclett.9B00522 |
0.358 |
|
| 2019 |
Wang H, Gu XK, Zheng X, Pan H, Zhu J, Chen S, Cao L, Li WX, Lu J. Disentangling the size-dependent geometric and electronic effects of palladium nanocatalysts beyond selectivity. Science Advances. 5: eaat6413. PMID 30746440 DOI: 10.1126/Sciadv.Aat6413 |
0.307 |
|
| 2019 |
Chen P, Liu J, Li W. Carbon Monoxide Activation on Cobalt Carbide for Fischer–TropschSynthesis from First-Principles Theory Acs Catalysis. 9: 8093-8103. DOI: 10.1021/Acscatal.9B00649 |
0.378 |
|
| 2019 |
Wan Q, Hu S, Dai J, Chen C, Li W. Influence of Crystal Facet and Phase of Titanium Dioxide on Ostwald Ripening of Supported Pt Nanoparticles from First-Principles Kinetics Journal of Physical Chemistry C. 123: 11020-11031. DOI: 10.1021/Acs.Jpcc.9B01942 |
0.332 |
|
| 2019 |
Zhang B, Chen P, Liu J, Su H, Li W. Influence of Cobalt Crystal Structures on Activation of Nitrogen Molecule: A First-Principles Study Journal of Physical Chemistry C. 123: 10956-10966. DOI: 10.1021/Acs.Jpcc.9B00590 |
0.397 |
|
| 2019 |
Wan Q, Hu S, Dai J, Chen C, Li W. First-Principles Kinetic Study for Ostwald Ripening of Late Transition Metals on TiO2(110) Journal of Physical Chemistry C. 123: 1160-1169. DOI: 10.1021/Acs.Jpcc.8B08530 |
0.378 |
|
| 2019 |
Hu S, Ouyang R, Li W. First-principles kinetics study of carbon monoxide promoted Ostwald ripening of Au particles on FeO/Pt(111) Journal of Energy Chemistry. 30: 108-113. DOI: 10.1016/J.Jechem.2018.03.023 |
0.366 |
|
| 2019 |
Li J, Liu J, Gao X, Goldsmith BR, Cong Y, Zhai Z, Miao S, Jiang Q, Dou Y, Wang J, Shi Q, Guo X, Wang D, Yu H, Li W, et al. Nitrogen-doped graphene layers for electrochemical oxygen reduction reaction boosted by lattice strain Journal of Catalysis. 378: 113-120. DOI: 10.1016/J.Jcat.2019.08.018 |
0.319 |
|
| 2019 |
Hu S, Li W. Metal-support interaction controlled migration and coalescence of supported particles Science China-Technological Sciences. 62: 762-772. DOI: 10.1007/S11431-018-9407-3 |
0.343 |
|
| 2018 |
Huang W, Li WX. Surface and interface design for heterogeneous catalysis. Physical Chemistry Chemical Physics : Pccp. PMID 30556573 DOI: 10.1039/C8Cp05717F |
0.357 |
|
| 2018 |
Wang S, Jian M, Su H, Li W. First-Principles Microkinetic Study of Methanol Synthesis on Cu(221) and ZnCu(221) Surfaces Chinese Journal of Chemical Physics. 31: 284-290. DOI: 10.1063/1674-0068/31/Cjcp1803038 |
0.324 |
|
| 2018 |
Shang S, Chen P, Wang L, Lv Y, Li W, Gao S. Metal-Free Nitrogen- and Boron-Codoped Mesoporous Carbons for Primary Amides Synthesis from Primary Alcohols via Direct Oxidative Dehydrogenation Acs Catalysis. 8: 9936-9944. DOI: 10.1021/Acscatal.8B02889 |
0.38 |
|
| 2018 |
Wells RH, Gu X, Li W, Skodje RT. Understanding Surface Catalyzed Decomposition Reactions Using a Chemical Pathway Analysis The Journal of Physical Chemistry C. 122: 28158-28172. DOI: 10.1021/Acs.Jpcc.8B09415 |
0.382 |
|
| 2018 |
Wang S, Gu X, Su H, Li W. First-Principles and Microkinetic Simulation Studies of the Structure Sensitivity of Cu Catalyst for Methanol Steam Reforming Journal of Physical Chemistry C. 122: 10811-10819. DOI: 10.1021/Acs.Jpcc.8B00085 |
0.367 |
|
| 2018 |
Sun K, Su H, Li W. Structures and stability of adsorbed methanol on TiO2(110) surface studied by ab initio thermodynamics and kinetic Monte Carlo simulation Theoretical Chemistry Accounts. 137: 128. DOI: 10.1007/S00214-018-2318-9 |
0.373 |
|
| 2017 |
Zhang Z, Wang SS, Song R, Cao T, Luo L, Chen X, Gao Y, Lu J, Li WX, Huang W. The most active Cu facet for low-temperature water gas shift reaction. Nature Communications. 8: 488. PMID 28887563 DOI: 10.1038/S41467-017-00620-6 |
0.333 |
|
| 2017 |
Gao Q, Huang CQ, Ju YM, Gao MR, Liu JW, An D, Cui CH, Zheng YR, Li WX, Yu SH. Phase Selective Synthesis of Unique Cobalt Telluride Nanofleeces for Highly Efficient Oxygen Evolution Catalyst. Angewandte Chemie (International Ed. in English). PMID 28467678 DOI: 10.1002/Anie.201701998 |
0.394 |
|
| 2017 |
Zhai P, Chen PP, Xie J, Liu JX, Zhao H, Lin L, Zhao B, Su HY, Zhu Q, Li WX, Ma D. Carbon induced selective regulation of cobalt-based Fischer-Tropsch catalysts by ethylene treatment. Faraday Discussions. PMID 28184397 DOI: 10.1039/C6Fd00194G |
0.388 |
|
| 2017 |
Li WZ, Liu JX, Gu J, Zhou W, Yao S, Si R, Guo Y, Su HY, Yan CH, Li WX, Zhang YW, Ma D. Chemical Insights into the Design and Development of Face-centered cubic Ruthenium Catalysts for Fischer-Tropsch Synthesis. Journal of the American Chemical Society. PMID 28099028 DOI: 10.1021/Jacs.6B10375 |
0.386 |
|
| 2017 |
Su H, Zhao Y, Liu J, Sun K, Li W. First-principles study of structure sensitivity of chain growth and selectivity in Fischer–Tropsch synthesis using HCP cobalt catalysts Catalysis Science & Technology. 7: 2967-2977. DOI: 10.1039/C7Cy00706J |
0.353 |
|
| 2017 |
Gu X, Huang C, Li W. First-principles study of single transition metal atoms on ZnO for the water gas shift reaction Catalysis Science & Technology. 7: 4294-4301. DOI: 10.1039/C7Cy00704C |
0.399 |
|
| 2017 |
Wang S, Su H, Gu X, Li W. Differentiating Intrinsic Reactivity of Copper, Copper–Zinc Alloy, and Copper/Zinc Oxide Interface for Methanol Steam Reforming by First-Principles Theory Journal of Physical Chemistry C. 121: 21553-21559. DOI: 10.1021/Acs.Jpcc.7B07703 |
0.396 |
|
| 2017 |
Huang C, Li W. Influence of nickel(II) oxide surface magnetism on molecule adsorption: A first-principles study Chinese Journal of Catalysis. 38: 1736-1748. DOI: 10.1016/S1872-2067(17)62883-3 |
0.364 |
|
| 2017 |
Gao Q, Huang C, Ju Y, Gao M, Liu J, An D, Cui C, Zheng Y, Li W, Yu S. Phase Selective Synthesis of Unique Cobalt Telluride Nanofleeces for Highly Efficient Oxygen Evolution Catalyst Angewandte Chemie. DOI: 10.1002/Ange.201701998 |
0.394 |
|
| 2016 |
Su HY, Sun K, Wang WQ, Zeng Z, Calle-Vallejo F, Li WX. Establishing and Understanding Adsorption-Energy Scaling Relations with Negative Slopes. The Journal of Physical Chemistry Letters. 7: 5302-5306. PMID 27973860 DOI: 10.1021/Acs.Jpclett.6B02430 |
0.311 |
|
| 2016 |
Wang C, Gu X, Yan H, Lin Y, Li J, Liu D, Li W, Lu J. Water-Mediated Mars–Van Krevelen Mechanism for CO Oxidation on Ceria-Supported Single-Atom Pt1 Catalyst Acs Catalysis. 7: 887-891. DOI: 10.1021/Acscatal.6B02685 |
0.321 |
|
| 2016 |
Liu J, Zhang B, Chen P, Su H, Li W. CO Dissociation on Face-Centered Cubic and Hexagonal Close-Packed Nickel Catalysts: A First-Principles Study Journal of Physical Chemistry C. 120: 24903. DOI: 10.1021/Acs.Jpcc.6B08742 |
0.401 |
|
| 2016 |
Lee HC, Kim BM, Jeong CK, Toyoshima R, Kondoh H, Shimada T, Mase K, Mao B, Liu Z, Lee H, Huang CQ, Li WX, Ross PN, Mun BS. Surface segregation and oxidation of Pt3Ni(1 1 1) alloys under oxygen environment Catalysis Today. 260: 3-7. DOI: 10.1016/J.Cattod.2015.05.003 |
0.367 |
|
| 2016 |
Liu J, Li W. Theoretical study of crystal phase effect in heterogeneous catalysis Wiley Interdisciplinary Reviews: Computational Molecular Science. 6: 571-583. DOI: 10.1002/Wcms.1267 |
0.371 |
|
| 2015 |
Pei YP, Liu JX, Zhao YH, Ding YJ, Liu T, Dong WD, Zhu HJ, Su HY, Yan L, Li JL, Li WX. High alcohols synthesis via fischer-tropsch reaction at cobalt metal/carbide interface Acs Catalysis. 5: 3620-3624. DOI: 10.1021/Acscatal.5B00791 |
0.366 |
|
| 2015 |
Wei D, Jin X, Huang C, Dai D, Ma Z, Li WX, Yang X. Direct Imaging Single Methanol Molecule Photocatalysis on Titania Journal of Physical Chemistry C. 119: 17748-17754. DOI: 10.1021/Acs.Jpcc.5B05074 |
0.346 |
|
| 2015 |
Gu J, Guo Y, Jiang YY, Zhu W, Xu YS, Zhao ZQ, Liu JX, Li WX, Jin CH, Yan CH, Zhang YW. Robust Phase Control through Hetero-Seeded Epitaxial Growth for Face-Centered Cubic Pt@Ru Nanotetrahedrons with Superior Hydrogen Electro-Oxidation Activity Journal of Physical Chemistry C. 119: 17697-17706. DOI: 10.1021/Acs.Jpcc.5B04587 |
0.343 |
|
| 2014 |
Hua Q, Cao T, Gu X, Lu J, Jiang Z, Pan X, Luo L, Li W, Huang W. Crystal‐Plane‐Controlled Selectivity of Cu2O Catalysts in Propylene Oxidation with Molecular Oxygen Angewandte Chemie. 53: 4856-4861. PMID 24692419 DOI: 10.1002/Anie.201402374 |
0.308 |
|
| 2014 |
Dong W, Liu J, Zhu H, Ding Y, Pei Y, Liu J, Du H, Jiang M, Liu T, Su H, Li W. Co-Co2C and Co-Co2C/AC Catalysts for Hydroformylation of 1-Hexene under Low Pressure: Experimental and Theoretical Studies Journal of Physical Chemistry C. 118: 19114-19122. DOI: 10.1021/Jp504215Y |
0.387 |
|
| 2014 |
Ding W, Gu X, Su H, Li W. Single Pd Atom Embedded in CeO2(111) for NO Reduction with CO: A First-Principles Study Journal of Physical Chemistry C. 118: 12216-12223. DOI: 10.1021/Jp503745C |
0.342 |
|
| 2014 |
Kramer ZC, Gu XK, Zhou DDY, Li WX, Skodje RT. Following molecules through reactive networks: Surface catalyzed decomposition of methanol on Pd(111), Pt(111), and Ni(111) Journal of Physical Chemistry C. 118: 12364-12383. DOI: 10.1021/Jp503056U |
0.365 |
|
| 2014 |
Ding W, Li W. First-principles study of NO reduction by CO on transition metal atoms-doped CeO2(111) Chinese Journal of Catalysis. 35: 1937-1943. DOI: 10.1016/S1872-2067(14)60169-8 |
0.392 |
|
| 2014 |
Sun K, Su H, Li W. Stability of polar ZnO surfaces studied by pair potential method and local energy density method Theoretical Chemistry Accounts. 133: 1427. DOI: 10.1007/S00214-013-1427-8 |
0.336 |
|
| 2014 |
Zhao Y, Liu J, Su H, Sun K, Li W. A First‐Principles Study of Carbon–Oxygen Bond Scission in Multiatomic Molecules on Flat and Stepped Metal Surfaces Chemcatchem. 6: 1755-1762. DOI: 10.1002/Cctc.201301114 |
0.407 |
|
| 2013 |
Liu J, Su H, Sun D, Zhang B, Li W. Crystallographic dependence of CO activation on cobalt catalysts: HCP versus FCC. Journal of the American Chemical Society. 135: 16284-16287. PMID 24147726 DOI: 10.1021/Ja408521W |
0.381 |
|
| 2013 |
Zhang C, Yu Y, Grass ME, Dejoie C, Ding W, Gaskell K, Jabeen N, Hong YP, Shavorskiy A, Bluhm H, Li WX, Jackson GS, Hussain Z, Liu Z, Eichhorn BW. Mechanistic studies of water electrolysis and hydrogen electro-oxidation on high temperature ceria-based solid oxide electrochemical cells. Journal of the American Chemical Society. 135: 11572-9. PMID 23822749 DOI: 10.1021/Ja402604U |
0.37 |
|
| 2013 |
Wang H, Zhou W, Liu JX, Si R, Sun G, Zhong MQ, Su HY, Zhao HB, Rodriguez JA, Pennycook SJ, Idrobo JC, Li WX, Kou Y, Ma D. Platinum-modulated cobalt nanocatalysts for low-temperature aqueous-phase Fischer-Tropsch synthesis. Journal of the American Chemical Society. 135: 4149-58. PMID 23428163 DOI: 10.1021/Ja400771A |
0.379 |
|
| 2013 |
Ouyang R, Liu J, Li W. Atomistic theory of Ostwald ripening and disintegration of supported metal particles under reaction conditions. Journal of the American Chemical Society. 135: 1760-1771. PMID 23272702 DOI: 10.1021/Ja3087054 |
0.341 |
|
| 2013 |
Deng X, Yao K, Sun K, Li WX, Lee J, Matranga C. Growth of single- and bilayer ZnO on Au(111) and interaction with copper Journal of Physical Chemistry C. 117: 11211-11218. DOI: 10.1021/Jp402008W |
0.329 |
|
| 2013 |
Ouyang R, Li W. Adsorbed CO induced change of the adsorption site and charge of Au adatoms on FeO(111)/Ru(0001) Chinese Journal of Catalysis. 34: 1820-1825. DOI: 10.1016/S1872-2067(12)60664-0 |
0.385 |
|
| 2013 |
Yao K, Wang S, Gu X, Su H, Li W. First-principles study of water activation on Cu-ZnO catalysts Chinese Journal of Catalysis. 34: 1705-1711. DOI: 10.1016/S1872-2067(12)60642-1 |
0.341 |
|
| 2013 |
Liu J, Su H, Li W. Structure sensitivity of CO methanation on Co (0 0 0 1), (101̄2) and (112̄0) surfaces: Density functional theory calculations Catalysis Today. 215: 36-42. DOI: 10.1016/J.Cattod.2013.04.024 |
0.374 |
|
| 2012 |
Gu XK, Ouyang R, Sun D, Su HY, Li WX. CO oxidation at the perimeters of an FeO/Pt(111) interface and how water promotes the activity: a first-principles study. Chemsuschem. 5: 871-8. PMID 22162485 DOI: 10.1002/Cssc.201100525 |
0.379 |
|
| 2012 |
Sun D, Gu X, Ouyang R, Su H, Fu Q, Bao X, Li W. Theoretical Study of the Role of a Metal-Cation Ensemble at the Oxide-Metal Boundary on CO Oxidation Journal of Physical Chemistry C. 116: 7491-7498. DOI: 10.1021/Jp300924K |
0.385 |
|
| 2012 |
Zhao Y, Su H, Sun K, Liu J, Li W. Structural and electronic properties of cobalt carbide Co2C and its surface stability: Density functional theory study Surface Science. 606: 598-604. DOI: 10.1016/J.Susc.2011.11.025 |
0.362 |
|
| 2011 |
Butcher DR, Grass ME, Zeng Z, Aksoy F, Bluhm H, Li WX, Mun BS, Somorjai GA, Liu Z. In situ oxidation study of Pt(110) and its interaction with CO. Journal of the American Chemical Society. 133: 20319-25. PMID 22070406 DOI: 10.1021/Ja207261S |
0.402 |
|
| 2011 |
Zhao YH, Sun K, Ma X, Liu J, Sun D, Su HY, Li WX. Carbon chain growth by formyl insertion on rhodium and cobalt catalysts in syngas conversion. Angewandte Chemie (International Ed. in English). 50: 5335-8. PMID 21557417 DOI: 10.1002/Anie.201100735 |
0.305 |
|
| 2011 |
Zhao Y, Yang M, Sun D, Su H, Sun K, Ma X, Bao X, Li W. Rh-Decorated Cu Alloy Catalyst for Improved C2 Oxygenate Formation from Syngas Journal of Physical Chemistry C. 115: 18247-18256. DOI: 10.1021/Jp204961G |
0.411 |
|
| 2011 |
Su H, Gu X, Ma X, Zhao Y, Bao X, Li W. Structure evolution of Pt–3d transition metal alloys under reductive and oxidizing conditions and effect on the CO oxidation: a first-principles study Catalysis Today. 165: 89-95. DOI: 10.1016/J.Cattod.2010.10.069 |
0.409 |
|
| 2011 |
Ma X, Su H, Deng H, Li W. Carbon monoxide adsorption and dissociation on Mn-decorated Rh(1 1 1) and Rh(5 5 3) surfaces: A first-principles study Catalysis Today. 160: 228-233. DOI: 10.1016/J.Cattod.2010.05.035 |
0.405 |
|
| 2010 |
Fu Q, Li WX, Yao Y, Liu H, Su HY, Ma D, Gu XK, Chen L, Wang Z, Zhang H, Wang B, Bao X. Interface-confined ferrous centers for catalytic oxidation. Science (New York, N.Y.). 328: 1141-4. PMID 20508127 DOI: 10.1126/Science.1188267 |
0.421 |
|
| 2010 |
Zeng Z, Silva JLFD, Li W. Theory of nitride oxide adsorption on transition metal (111) surfaces: a first-principles investigation Physical Chemistry Chemical Physics. 12: 2459-2470. PMID 20449360 DOI: 10.1039/B920857G |
0.381 |
|
| 2010 |
Zeng Z, Silva JLFD, Li W. Density functional theory and ab initio molecular dynamics study of NO adsorption on Pd(111) and Pt(111) surfaces Physical Review B. 81: 85408. DOI: 10.1103/Physrevb.81.085408 |
0.369 |
|
| 2010 |
Gu X, Li W. First-Principles Study on the Origin of the Different Selectivities for Methanol Steam Reforming on Cu(111) and Pd(111) Journal of Physical Chemistry C. 114: 21539-21547. DOI: 10.1021/Jp107678D |
0.327 |
|
| 2010 |
Zeng Z, Ma X, Ding W, Li W. First-principles calculation of core-level binding energy shift in surface chemical processes Science China-Chemistry. 53: 402-410. DOI: 10.1007/S11426-010-0086-Z |
0.381 |
|
| 2009 |
Ma T, Fu Q, Su H, Liu H, Cui Y, Wang Z, Mu R, Li W, Bao X. Reversible structural modulation of Fe-Pt bimetallic surfaces and its effect on reactivity. Chemphyschem. 10: 1013-1016. PMID 19399822 DOI: 10.1002/Cphc.200900053 |
0.369 |
|
| 2009 |
Zeng Z, Silva JLFD, Deng H, Li W. Density functional theory study of the energetics, electronic structure, and core-level shifts of NO adsorption on the Pt(111) surface Physical Review B. 79: 205413. DOI: 10.1103/Physrevb.79.205413 |
0.396 |
|
| 2009 |
Zhang H, Li W. First-Principles Investigation of Surface and Subsurface H Adsorption on Ir(111) The Journal of Physical Chemistry C. 113: 21361-21367. DOI: 10.1021/Jp9074866 |
0.381 |
|
| 2009 |
Su H, Zeng Z, Bao X, Li W. First-Principles Study of Carbon Monoxide Oxidation on Ag(111) in Presence of Subsurface Oxygen and Stepped Ag(221) Journal of Physical Chemistry C. 113: 8266-8272. DOI: 10.1021/Jp809436H |
0.364 |
|
| 2009 |
Sun K, Li W, Feng Z, Li C. Cooperative activation in ring-opening hydrolysis of epoxides by Co-salen complexes: A first principle study Chemical Physics Letters. 470: 259-263. DOI: 10.1016/J.Cplett.2009.01.044 |
0.373 |
|
| 2008 |
Ma X, Deng H, Yang M, Li W. Atomic and molecular adsorption on RhMn alloy surface: a first principles study. Journal of Chemical Physics. 129: 244711-244711. PMID 19123530 DOI: 10.1063/1.3046691 |
0.368 |
|
| 2008 |
Su H, Bao X, Li W. Modulating the reactivity of Ni-containing Pt(111)-skin catalysts by density functional theory calculations Journal of Chemical Physics. 128: 194707-194707. PMID 18500886 DOI: 10.1063/1.2920174 |
0.448 |
|
| 2008 |
Yao Y, Liu X, Fu Q, Li W, Tan D, Bao X. Unique reactivity of confined metal atoms on a silicon substrate. Chemphyschem. 9: 975-979. PMID 18351687 DOI: 10.1002/Cphc.200700840 |
0.345 |
|
| 2008 |
Li W. Oxidation of platinum surfaces and reaction with carbon monoxide Journal of Physics: Condensed Matter. 20: 184022. DOI: 10.1088/0953-8984/20/18/184022 |
0.423 |
|
| 2008 |
Su H, Yang M, Bao X, Li W. The Effect of Water on the CO Oxidation on Ag(111) and Au(111) Surfaces: A First-Principle Study Journal of Physical Chemistry C. 112: 17303-17310. DOI: 10.1021/Jp803400P |
0.39 |
|
| 2008 |
Resta A, Gustafson J, Westerström R, Mikkelsen A, Lundgren E, Andersen JN, Yang MM, Ma XF, Bao XH, Li WX. Step enhanced dehydrogenation of ethanol on Rh Surface Science. 602: 3057-3063. DOI: 10.1016/J.Susc.2008.08.004 |
0.305 |
|
| 2007 |
Yang M, Bao X, Li W. Density functional theory study of CHx (x=1-3) adsorption on clean and CO precovered Rh(111) surfaces Journal of Chemical Physics. 127: 24705. PMID 17640143 DOI: 10.1063/1.2751155 |
0.34 |
|
| 2007 |
Ma X, Jiang P, Qi Y, Jia J, Yang Y, Duan W, Li WX, Bao X, Zhang SB, Xue QK. Experimental observation of quantum oscillation of surface chemical reactivities. Proceedings of the National Academy of Sciences of the United States of America. 104: 9204-8. PMID 17517632 DOI: 10.1073/Pnas.0611024104 |
0.312 |
|
| 2007 |
Yang M, Bao X, Li W. First principle study of ethanol adsorption and formation of hydrogen bond on Rh(111) surface Journal of Physical Chemistry C. 111: 7403-7410. DOI: 10.1021/Jp0686184 |
0.332 |
|
| 2005 |
Wang JG, Li WX, Borg M, Gustafson J, Mikkelsen A, Pedersen TM, Lundgren E, Weissenrieder J, Klikovits J, Schmid M, Hammer B, Andersen JN. One-dimensional PtO2 at Pt steps: formation and reaction with CO. Physical Review Letters. 95: 256102. PMID 16384475 DOI: 10.1103/Physrevlett.95.256102 |
0.373 |
|
| 2003 |
Li WX, Stampfl C, Scheffler M. Why is a noble metal catalytically active? The role of the O-Ag interaction in the function of silver as an oxidation catalyst. Physical Review Letters. 90: 256102. PMID 12857148 DOI: 10.1103/Physrevlett.90.256102 |
0.382 |
|
| 2003 |
Li W, Stampfl C, Scheffler M. Insights into the function of silver as an oxidation catalyst by ab initio atomistic thermodynamics Physical Review B. 68. DOI: 10.1103/Physrevb.68.165412 |
0.409 |
|
| 2003 |
Li W, Stampfl C, Scheffler M. Subsurface oxygen and surface oxide formation at Ag(111): A density-functional theory investigation Physical Review B. 67. DOI: 10.1103/Physrevb.67.045408 |
0.39 |
|
| 2002 |
Li W, Stampfl C, Scheffler M. Oxygen adsorption on Ag(111): A density-functional theory investigation Physical Review B. 65. DOI: 10.1103/Physrevb.65.075407 |
0.394 |
|
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