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Hongliang Xin - Publications

Affiliations: 
Virginia Polytechnic Institute and State University, Blacksburg, VA, United States 
Area:
Catalysis
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40 high-probability publications. We are testing a new system for linking publications to authors. You can help! If you notice any inaccuracies, please sign in and mark papers as correct or incorrect matches. If you identify any major omissions or other inaccuracies in the publication list, please let us know.

Year Citation  Score
2023 Pillai HS, Li Y, Wang SH, Omidvar N, Mu Q, Achenie LEK, Abild-Pedersen F, Yang J, Wu G, Xin H. Interpretable design of Ir-free trimetallic electrocatalysts for ammonia oxidation with graph neural networks. Nature Communications. 14: 792. PMID 36774355 DOI: 10.1038/s41467-023-36322-5  0.398
2022 Xie S, Liu L, Lu Y, Wang C, Cao S, Diao W, Deng J, Tan W, Ma L, Ehrlich SN, Li Y, Zhang Y, Ye K, Xin H, Flytzani-Stephanopoulos M, et al. Pt Atomic Single-Layer Catalyst Embedded in Defect-Enriched Ceria for Efficient CO Oxidation. Journal of the American Chemical Society. PMID 36322840 DOI: 10.1021/jacs.2c08902  0.375
2020 Wang S, Pillai HS, Xin H. Bayesian learning of chemisorption for bridging the complexity of electronic descriptors. Nature Communications. 11: 6132. PMID 33257689 DOI: 10.1038/s41467-020-19524-z  0.347
2020 Rao Y, Wang S, Zhang R, Jiang S, Chen S, Yu Y, Bao S, Xu M, Yue Q, Xin H, Kang Y. Nanoporous V-Doped NiP Microsphere: A Highly Efficient Electrocatalyst for Hydrogen Evolution Reaction at All pH. Acs Applied Materials & Interfaces. 12: 37092-37099. PMID 32814405 DOI: 10.1021/Acsami.0C08202  0.344
2020 Li Y, Li X, Pillai HS, Lattimer J, Mohd Adli N, Karakalos S, Chen M, Guo L, Xu H, Yang J, Su D, Xin H, Wu G. Ternary PtIrNi Catalysts for Efficient Electrochemical Ammonia Oxidation Acs Catalysis. 10: 3945-3957. DOI: 10.1021/Acscatal.9B04670  0.372
2019 Li Z, Qi Z, Wang S, Ma T, Zhou L, Wu Z, Luan X, Lin FY, Chen M, Miller JT, Xin H, Huang W, Wu Y. In Situ Formed Pt3Ti Nanoparticles on a Two-dimensional Transition Metal Carbide (MXene) Used as Efficient Catalysts for Hydrogen Evolution Reactions. Nano Letters. PMID 31271283 DOI: 10.1021/Acs.Nanolett.9B01381  0.454
2019 Guan Q, Yang C, Wang S, He L, Kong Z, Chai X, Xin H, Ning P. Reactive Metal–Biopolymer Interactions for Semihydrogenation of Acetylene Acs Catalysis. 9: 11146-11152. DOI: 10.1021/Acscatal.9B04042  0.349
2019 Pillai HS, Xin H. New Insights into Electrochemical Ammonia Oxidation on Pt(100) from First Principles Industrial & Engineering Chemistry Research. 58: 10819-10828. DOI: 10.1021/Acs.Iecr.9B01471  0.348
2019 Wang S, Xin H. Predicting Catalytic Activity of High-Entropy Alloys for Electrocatalysis Chem. 5: 502-504. DOI: 10.1016/J.Chempr.2019.02.015  0.474
2018 Li Z, Yu L, Milligan C, Ma T, Zhou L, Cui Y, Qi Z, Libretto N, Xu B, Luo J, Shi E, Wu Z, Xin H, Delgass WN, Miller JT, et al. Two-dimensional transition metal carbides as supports for tuning the chemistry of catalytic nanoparticles. Nature Communications. 9: 5258. PMID 30531995 DOI: 10.1038/S41467-018-07502-5  0.468
2018 Wang S, Omidvar N, Marx E, Xin H. Overcoming Site Heterogeneity In Search of Metal Nanocatalysts. Acs Combinatorial Science. PMID 30183261 DOI: 10.1021/Acscombsci.8B00070  0.452
2018 Wang J, Yu L, Hu L, Chen G, Xin H, Feng X. Ambient ammonia synthesis via palladium-catalyzed electrohydrogenation of dinitrogen at low overpotential. Nature Communications. 9: 1795. PMID 29765053 DOI: 10.1038/S41467-018-04213-9  0.335
2018 Li Z, Omidvar N, Chin WS, Robb E, Morris AJ, Achenie LEK, Xin H. Machine Learning Energy Gaps of Porphyrins with Molecular Graph Representations. The Journal of Physical Chemistry. A. PMID 29688014 DOI: 10.1021/Acs.Jpca.8B02842  0.343
2018 Wang S, Omidvar N, Marx E, Xin H. Coordination numbers for unraveling intrinsic size effects in gold-catalyzed CO oxidation. Physical Chemistry Chemical Physics : Pccp. PMID 29435548 DOI: 10.1039/C8Cp00102B  0.372
2017 LaRue J, Krejčí O, Yu L, Beye M, Ng ML, Öberg H, Xin H, Mercurio G, Moeller SP, Turner JJ, Nordlund D, Coffee R, Minitti MP, Wurth W, Pettersson LGM, et al. Real-Time Elucidation of Catalytic Pathways in CO Hydrogenation on Ru. The Journal of Physical Chemistry Letters. PMID 28759996 DOI: 10.1021/Acs.Jpclett.7B01549  0.371
2017 Ma X, Xin H. Orbitalwise Coordination Number for Predicting Adsorption Properties of Metal Nanocatalysts. Physical Review Letters. 118: 036101. PMID 28157336 DOI: 10.1103/Physrevlett.118.036101  0.405
2017 Luc WW, Collins C, Wang S, Xin H, He K, Kang Y, Jiao F. Ag-Sn Bimetallic Catalyst with a Core-Shell Structure for CO2 Reduction. Journal of the American Chemical Society. PMID 28094994 DOI: 10.1021/Jacs.6B10435  0.433
2017 Li Z, Wang S, Chin WS, Achenie LE, Xin H. High-throughput screening of bimetallic catalysts enabled by machine learning Journal of Materials Chemistry A. 5: 24131-24138. DOI: 10.1039/C7Ta01812F  0.325
2017 Wang S, Wang J, Xin H. Insights into electrochemical CO2 reduction on tin oxides from first-principles calculations Green Energy & Environment. 2: 168-171. DOI: 10.1016/J.Gee.2017.02.005  0.338
2017 Li Z, Ma X, Xin H. Feature engineering of machine-learning chemisorption models for catalyst design Catalysis Today. 280: 232-238. DOI: 10.1016/J.Cattod.2016.04.013  0.443
2016 Xin H, Linic S. Analyzing relationships between surface perturbations and local chemical reactivity of metal sites: Alkali promotion of O2 dissociation on Ag(111). The Journal of Chemical Physics. 144: 234704. PMID 27334187 DOI: 10.1063/1.4953906  0.664
2015 Ma X, Li Z, Achenie LE, Xin H. Machine-Learning-Augmented Chemisorption Model for CO2 Electroreduction Catalyst Screening. The Journal of Physical Chemistry Letters. 6: 3528-3533. PMID 26722718 DOI: 10.1021/Acs.Jpclett.5B01660  0.448
2015 Xin H, LaRue J, Öberg H, Beye M, Dell'Angela M, Turner JJ, Gladh J, Ng ML, Sellberg JA, Kaya S, Mercurio G, Hieke F, Nordlund D, Schlotter WF, Dakovski GL, et al. Strong Influence of Coadsorbate Interaction on CO Desorption Dynamics on Ru(0001) Probed by Ultrafast X-Ray Spectroscopy and Ab Initio Simulations. Physical Review Letters. 114: 156101. PMID 25933322 DOI: 10.1103/Physrevlett.114.156101  0.347
2015 Öström H, Öberg H, Xin H, LaRue J, Beye M, Dell'Angela M, Gladh J, Ng ML, Sellberg JA, Kaya S, Mercurio G, Nordlund D, Hantschmann M, Hieke F, Kühn D, et al. Surface chemistry. Probing the transition state region in catalytic CO oxidation on Ru. Science (New York, N.Y.). 347: 978-82. PMID 25722407 DOI: 10.1126/Science.1261747  0.315
2015 Ma X, Carneiro JSA, Gu XK, Qin H, Xin H, Sun K, Nikolla E. Engineering Complex, Layered Metal Oxides: High-Performance Nickelate Oxide Nanostructures for Oxygen Exchange and Reduction Acs Catalysis. 5: 4013-4019. DOI: 10.1021/Acscatal.5B00756  0.676
2014 Kale MJ, Avanesian T, Xin H, Yan J, Christopher P. Controlling catalytic selectivity on metal nanoparticles by direct photoexcitation of adsorbate-metal bonds. Nano Letters. 14: 5405-12. PMID 25111312 DOI: 10.1021/Nl502571B  0.667
2014 Xin H, Vojvodic A, Voss J, Nørskov JK, Abild-Pedersen F. Effects of d -band shape on the surface reactivity of transition-metal alloys Physical Review B - Condensed Matter and Materials Physics. 89. DOI: 10.1103/Physrevb.89.115114  0.416
2013 Linic S, Christopher P, Xin H, Marimuthu A. Catalytic and photocatalytic transformations on metal nanoparticles with targeted geometric and plasmonic properties. Accounts of Chemical Research. 46: 1890-9. PMID 23750539 DOI: 10.1021/Ar3002393  0.737
2013 Xin H, Holewinski A, Nikolla E, Linic S. Identifying optimal active sites for heterogeneous catalysis by metal alloys based on molecular descriptors and electronic structure engineering Computational Molecular Science and Engineering Forum 2013 - Core Programming Area At the 2013 Aiche Annual Meeting: Global Challenges For Engineering a Sustainable Future. 1. DOI: 10.1016/J.Coche.2013.04.006  0.747
2012 Christopher P, Xin H, Marimuthu A, Linic S. Singular characteristics and unique chemical bond activation mechanisms of photocatalytic reactions on plasmonic nanostructures. Nature Materials. 11: 1044-50. PMID 23178296 DOI: 10.1038/Nmat3454  0.718
2012 Xin H, Holewinski A, Linic S. Predictive structurereactivity models for rapid screening of pt-based multimetallic electrocatalysts for the oxygen reduction reaction Acs Catalysis. 2: 12-16. DOI: 10.1021/Cs200462F  0.79
2012 Xin H, Holewinski A, Schweitzer N, Nikolla E, Linic S. Electronic structure engineering in heterogeneous catalysis: Identifying novel alloy catalysts based on rapid screening for materials with desired electronic properties Topics in Catalysis. 55: 376-390. DOI: 10.1007/S11244-012-9794-2  0.745
2011 Christopher P, Xin H, Linic S. Visible-light-enhanced catalytic oxidation reactions on plasmonic silver nanostructures. Nature Chemistry. 3: 467-72. PMID 21602862 DOI: 10.1038/Nchem.1032  0.704
2010 Xin H, Linic S. Communications: Exceptions to the d-band model of chemisorption on metal surfaces: The dominant role of repulsion between adsorbate states and metal d-states. The Journal of Chemical Physics. 132: 221101. PMID 20550380 DOI: 10.1063/1.3437609  0.586
2010 Xin H, Schweitzer N, Nikolla E, Linic S. Communications: Developing relationships between the local chemical reactivity of alloy catalysts and physical characteristics of constituent metal elements. The Journal of Chemical Physics. 132: 111101. PMID 20331272 DOI: 10.1063/1.3336015  0.785
2010 Xin H, Linic S. Communications: Exceptions to the d -band model of chemisorption on metal surfaces: The dominant role of repulsion between adsorbate states and metal d -states Journal of Chemical Physics. 132. DOI: 10.1063/1.3437609  0.559
2010 Schweitzer N, Xin H, Nikolla E, Miller JT, Linic S. Establishing relationships between the geometric structure and chemical reactivity of alloy catalysts based on their measured electronic structure Topics in Catalysis. 53: 348-356. DOI: 10.1007/S11244-010-9448-1  0.783
2008 Linic S, Xin H. Adsorbate-adsorbate interactions in heterogeneous catalysis: DFT and Ab initio thermodynamic studies of pressure- and temperature-dependant impact of alkalis on oxidation reactions Aiche Annual Meeting, Conference Proceedings.  0.537
2008 Xin H, Linic S. Adsorbate-adsorbate interactions in heterogeneous catalysis: DFT and Ab initio thermodynamic studies of pressure and temperature dependant impact of alkalis on oxidation reactions Aiche 100 - 2008 Aiche Annual Meeting, Conference Proceedings.  0.537
2007 Linic S, Mukherjee J, Xin H. Adsorbate-adsorbate interactions on surfaces: First principles studies of alkali promotion in chemical reaction on metal surfaces 2007 Aiche Annual Meeting.  0.583
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