The DOI matches its Crossref record; 83 of the 83 references it cites were found in a registry or an index.
Reactivity Theory of Transition-Metal Surfaces: A Brønsted−Evans−Polanyi Linear Activation Energy−Free-Energy Analysis
Abstract
no abstract
Overview
The claims and statistics of this paper haven’t been checked yet.
Run the check — free, no account needed. It reads the open-access text and checks the sources it cites.
Integrity signals
Registry
Cites
Statistics
Verification
Claims the paper makes
The claims and statistics of this paper haven’t been checked yet.
Run the check — free, no account needed. It reads the open-access text and checks the sources it cites.
Self-check
Percentages, sums and reported differences re-computed from the paper’s own numbers.
The self-check needs the paper’s full text.
Citations
Cites
Chemical and Electrochemical Electron-Transfer Theory
Marcus, R. A. (1964) · Annual Review of Physical Chemistry · doi:10.1146/annurev.pc.15.100164.001103 · Cited by 4,408
Valden, M., Lai, X., & Goodman, D. W. (1998) · Science · doi:10.1126/science.281.5383.1647 · Cited by 4,136
The Conservation of Orbital Symmetry
Woodward, R. B., & Hoffmann, R. (1969) · Angewandte Chemie International Edition in English · doi:10.1002/anie.196907811 · Cited by 4,090
Theoretical surface science and catalysis—calculations and concepts
Hammer, B., & Nørskov, J. K. (2000) · Advances in Catalysis · doi:10.1016/s0360-0564(02)45013-4 · Cited by 3,972
Why gold is the noblest of all the metals
Hammer, B., & Norskov, J. K. (1995) · Nature · doi:10.1038/376238a0 · Cited by 3,935
A Correlation of Reaction Rates
Hammond, G. S. (1955) · Journal of the American Chemical Society · doi:10.1021/ja01607a027 · Cited by 3,559
Effect of Strain on the Reactivity of Metal Surfaces
Mavrikakis, M., Hammer, B., & Nørskov, J. K. (1998) · Physical Review Letters · doi:10.1103/physrevlett.81.2819 · Cited by 2,380
Charge, bond order and valence in the AB initio SCF theory
Mayer, I. (1983) · Chemical Physics Letters · doi:10.1016/0009-2614(83)80005-0 · Cited by 2,267
Mizuno, N., & Misono, M. (1998) · Chemical Reviews · doi:10.1021/cr960401q · Cited by 2,062
The Brønsted–Evans–Polanyi relation and the volcano curve in heterogeneous catalysis
Bligaard, T., Nørskov, J. K., Dahl, S., Matthiesen, J., Christensen, C. H., & Sehested, J. (2004) · Journal of Catalysis · doi:10.1016/j.jcat.2004.02.034 · Cited by 1,713
Carbon‐Hydrogen‐Transition Metal Bonds
Brookhart, M., Green, M. L. H., & Wong, L. (1988) · Progress in Inorganic Chemistry · doi:10.1002/9780470166376.ch1 · Cited by 1,688
Inertia and driving force of chemical reactions
Evans, M. G., & Polanyi, M. (1938) · Transactions of the Faraday Society · doi:10.1039/tf9383400011 · Cited by 1,679
Abild-Pedersen, F., Greeley, J., Studt, F., Rossmeisl, J., Munter, T. R., Moses, P. G., Skúlason, E., Bligaard, T., & Nørskov, J. K. (2007) · Physical Review Letters · doi:10.1103/physrevlett.99.016105 · Cited by 1,678
Principles of Adsorption and Reaction on Solid Surfaces
Masel, R. I. (1996) · Cited by 1,531
Bezemer, G. L., Bitter, J. H., Kuipers, H. P. C. E., Oosterbeek, H., Holewijn, J. E., Xu, X., Kapteijn, F., van Dillen, A. J., & de Jong, K. P. (2006) · Journal of the American Chemical Society · doi:10.1021/ja058282w · Cited by 1,496
Ammonia Synthesis from First-Principles Calculations
Honkala, K., Hellman, A., Remediakis, I. N., Logadottir, A., Carlsson, A., Dahl, S., Christensen, C. H., & Nørskov, J. K. (2005) · Science · doi:10.1126/science.1106435 · Cited by 1,336
The Chemical Physics of Solid Surfaces and Heterogeneous Catalysis
(1988) · The Chemical Physics of Solid Surfaces · doi:10.1016/b978-0-444-42782-3.50001-7 · Cited by 1,333
Kinetics of Heterogeneous Catalytic Reactions
Boudart, M., & Djega-Mariadassou, G. (1984) · Princeton University Press eBooks · doi:10.1515/9781400853335 · Cited by 1,215
Steam Reforming and Graphite Formation on Ni Catalysts
Bengaard, H. S., Nørskov, J. K., Sehested, J., Clausen, B. S., Nielsen, L. P., Molenbroek, A. M., & Rostrup-Nielsen, J. R. (2002) · Journal of Catalysis · doi:10.1006/jcat.2002.3579 · Cited by 1,108
Production of Syngas by Direct Catalytic Oxidation of Methane
Hickman, D. A., & Schmidt, L. D. (1993) · Science · doi:10.1126/science.259.5093.343 · Cited by 932
Boudart, M. (1969) · Advances in Catalysis · doi:10.1016/s0360-0564(08)60271-0 · Cited by 824
Bell, R. P. (1973) · Springer eBooks · doi:10.1007/978-1-4757-1592-7 · Cited by 756
Röper, M. (1983) · Catalysis by Metal Complexes · doi:10.1007/978-94-009-7040-3_3 · Cited by 685
The Influence of Particle Size on the Catalytic Properties of Supported Metals
Che, M., & Bennett, C. O. (1989) · Advances in Catalysis · doi:10.1016/s0360-0564(08)60017-6 · Cited by 677
Complementary Structure Sensitive and Insensitive Catalytic Relationships
Van Santen, R. A. (2009) · Accounts of Chemical Research · doi:10.1021/ar800022m · Cited by 655
Self-citationMichaelides, A., Liu, Z.-P., Zhang, C. J., Alavi, A., King, D. A., & Hu, P. (2003) · Journal of the American Chemical Society · doi:10.1021/ja027366r · Cited by 645
Catalytic hydrogenolysis and dehydrogenation over copper-nickel alloys
SINFELT, J. (1972) · Journal of Catalysis · doi:10.1016/0021-9517(72)90072-3 · Cited by 635
Liu, Z.-P., & Hu, P. (2003) · Journal of the American Chemical Society · doi:10.1021/ja0207551 · Cited by 620
Bickelhaupt, F. M. (1999) · Journal of Computational Chemistry · doi:10.1002/(sici)1096-987x(19990115)20:1<114::aid-jcc12>3.0.co;2-l · Cited by 602
Homogeneous Catalysis: Understanding the Art
van Leeuwen, P. W. N. M. (2004) · Springer eBooks · doi:10.1007/1-4020-2000-7 · Cited by 521
Partial Dissociation of Water on Ru(0001)
Feibelman, P. J. (2002) · Science · doi:10.1126/science.1065483 · Cited by 496
Structure sensitivity of the methanation reaction: H2-induced CO dissociation on nickel surfaces
Andersson, M. P., Abild-Pedersen, F., Remediakis, I. N., Bligaard, T., Jones, G., Engbæk, J., Lytken, O., Horch, S., Nielsen, J. H., Sehested, J., et al. (2008) · Journal of Catalysis · doi:10.1016/j.jcat.2007.12.016 · Cited by 472
Gajdo, M., Eichler, A., & Hafner, J. (2004) · Journal of Physics: Condensed Matter · doi:10.1088/0953-8984/16/8/001 · Cited by 463
Mechanism of Hydrocarbon Synthesis over Fischer-Tropsch Catalysts
Biloen, P., & Sachtler, W. M. H. (1981) · Advances in catalysis · doi:10.1016/s0360-0564(08)60328-4 · Cited by 428
Pallassana, V., & Neurock, M. (2000) · Journal of Catalysis · doi:10.1006/jcat.1999.2724 · Cited by 402
Self-citationLa Catalyse en chimie organique
Sabatier, P. (2013) · Nouveau Monde eBooks · doi:10.14375/np.9782369430186 · Cited by 361
Catalytic Water Formation on Platinum: A First-Principles Study
Michaelides, A., & Hu, P. (2001) · Journal of the American Chemical Society · doi:10.1021/ja003576x · Cited by 359
Chemical Bonding at Surfaces and Interfaces
(2008) · Elsevier eBooks · doi:10.1016/b978-0-444-52837-7.x5001-1 · Cited by 329
Molecular Heterogeneous Catalysis: A Conceptual and Computational Approach
van Santen, R. A., & Neurock, M. (2006) · Wiley eBooks · doi:10.1002/9783527610846 · Cited by 323
Self-citationChemical Kinetics and Catalysis
van Santen, R. A., & Niemantsverdriet, J. W. (1995) · Fundamental and Applied Catalysis · doi:10.1007/978-1-4757-9643-8 · Cited by 315
Self-citationThorn, D. L., & Hoffmann, R. (1978) · Journal of the American Chemical Society · doi:10.1021/ja00475a018 · Cited by 302
Die katalytische Zersetzung des Nitramids und ihre physikalisch-chemische Bedeutung
Brönsted, J. N., & Pedersen, K. (1924) · Zeitschrift für Physikalische Chemie · doi:10.1515/zpch-1924-10814 · Cited by 302
Concepts in Theoretical Heterogeneous Catalytic Reactivity
VAN SANTEN, R. A., & NEUROCK, M. (1995) · Catalysis Reviews · doi:10.1080/01614949508006451 · Cited by 289
Self-citationInderwildi, O. R., Jenkins, S. J., & King, D. A. (2008) · The Journal of Physical Chemistry C · doi:10.1021/jp710674q · Cited by 275
Organometallic migration reactions
Berke, H., & Hoffmann, R. (1978) · Journal of the American Chemical Society · doi:10.1021/ja00491a018 · Cited by 253
Michaelides, A., Alavi, A., & King, D. A. (2003) · Journal of the American Chemical Society · doi:10.1021/ja028855u · Cited by 244
General trends in CO dissociation on transition metal surfaces
Liu, Z.-P., & Hu, P. (2001) · The Journal of Chemical Physics · doi:10.1063/1.1372512 · Cited by 231
Periodic trends in hydrodesulfurization: in support of the Sabatier principle
Chianelli, R. R., Berhault, G., Raybaud, P., Kasztelan, S., Hafner, J., & Toulhoat, H. (2002) · Applied Catalysis A: General · doi:10.1016/s0926-860x(01)00924-3 · Cited by 220
Electrocatalytic oxidation of ammonia on Pt(111) and Pt(100) surfaces
Rosca, V., & Koper, M. T. M. (2006) · Physical Chemistry Chemical Physics · doi:10.1039/b601306f · Cited by 195
Catalysis by Zeolites – Science and Technology
(1994) · Studies in Surface Science and Catalysis · doi:10.1016/s0167-2991(08)63680-0 · Cited by 188
The bonding of CO to metal surfaces
Föhlisch, A., Nyberg, M., Bennich, P., Triguero, L., Hasselström, J., Karis, O., Pettersson, L. G. M., & Nilsson, A. (2000) · The Journal of Chemical Physics · doi:10.1063/1.480773 · Cited by 185
CHENG, J., GONG, X., HU, P., LOK, C., ELLIS, P., & FRENCH, S. (2008) · Journal of Catalysis · doi:10.1016/j.jcat.2008.01.009 · Cited by 181
Loffreda, D., Simon, D., & Sautet, P. (1998) · The Journal of Chemical Physics · doi:10.1063/1.476051 · Cited by 177
Theoretical description of molecule-metal interaction and surface reactions
Lundqvist, B. I., Gunnarsson, O., Hjelmberg, H., & Nørskov, J. K. (1979) · Surface Science · doi:10.1016/0039-6028(79)90608-3 · Cited by 174
General trends in the barriers of catalytic reactions on transition metal surfaces
Liu, Z.-P., & Hu, P. (2001) · The Journal of Chemical Physics · doi:10.1063/1.1403006 · Cited by 173
How Carbon Monoxide Adsorbs in Different Sites
Föhlisch, A., Nyberg, M., Hasselström, J., Karis, O., Pettersson, L. G. M., & Nilsson, A. (2000) · Physical Review Letters · doi:10.1103/physrevlett.85.3309 · Cited by 168
Adsorption and Activation of CO over Flat and Stepped Co Surfaces: A First Principles Analysis
Ge, Q., & Neurock, M. (2006) · The Journal of Physical Chemistry B · doi:10.1021/jp060477i · Cited by 164
Self-citationCarbon Monoxide Dissociation on Planar and Stepped Ru(0001) Surfaces
Ciobica, I. M., & van Santen, R. A. (2003) · The Journal of Physical Chemistry B · doi:10.1021/jp030010x · Cited by 161
Self-citationThe Nanoscience Revolution: Merging of Colloid Science, Catalysis and Nanoelectronics
Somorjai, G. A., Tao, F., & Park, J. Y. (2008) · Topics in Catalysis · doi:10.1007/s11244-007-9028-1 · Cited by 159
Diefenbach, A., de Jong, G. T., & Bickelhaupt, F. M. (2005) · Journal of Chemical Theory and Computation · doi:10.1021/ct0499478 · Cited by 156
Raybaud, P., Kresse, G., Häfner, J., & Toulhoat, H. (1997) · Journal of Physics Condensed Matter · doi:10.1088/0953-8984/9/50/013 · Cited by 151
Thermally activated oxidation of NHs on Pt(111): intermediate species and reaction mechanisms
Mieher, W. D., & Ho, W. (1995) · Surface Science · doi:10.1016/0039-6028(95)90026-8 · Cited by 146
Novell-Leruth, G., Valcárcel, A., Pérez‐Ramírez, J., & Ricart, J. M. (2006) · The Journal of Physical Chemistry C · doi:10.1021/jp064742b · Cited by 146
Nagorny, K., & Hein, H. (1977) · Zeitschrift für Physikalische Chemie · doi:10.1524/zpch.1977.108.2.185 · Cited by 146
Selective Low Temperature NH3 Oxidation to N2 on Copper-Based Catalysts
Gang, L., van Grondelle, J., Anderson, B. G., & van Santen, R. A. (1999) · Journal of Catalysis · doi:10.1006/jcat.1999.2524 · Cited by 142
Ammonia activation on platinum {111}: A density functional theory study
Offermans, W., Jansen, A. P. J., & van Santen, R. A. (2006) · Surface Science · doi:10.1016/j.susc.2006.01.031 · Cited by 137
Cheng, J. J., Hu, P., Ellis, P. R., French, S., Kelly, G. J., & Lok, C. M. (2008) · The Journal of Physical Chemistry C · doi:10.1021/jp711051e · Cited by 128
The catalytic role of water in CO oxidation
Gong, X., Hu, P., & Raval, R. (2003) · The Journal of Chemical Physics · doi:10.1063/1.1602053 · Cited by 125
Dehydrogenation of Light Alkanes over Zeolites
Narbeshuber, T. F., Brait, A., Seshan, K., & Lercher, J. A. (1997) · Journal of Catalysis · doi:10.1006/jcat.1997.1860 · Cited by 119
Pidko, E. A., Kazansky, V. B., Hensen, E. J. M., & van Santen, R. A. (2006) · Journal of Catalysis · doi:10.1016/j.jcat.2006.03.011 · Cited by 117
Imbihl, R., Scheibe, A., Zeng, Y. F., Günther, S., Kraehnert, R., Kondratenko, V. A., Baerns, M., Offermans, W. K., Jansen, A. P. J., & van Santen, R. A. (2007) · Physical Chemistry Chemical Physics · doi:10.1039/b700866j · Cited by 115
Heterogeneous catalysis of C–C bond formation: black art or organometallic science?
Maitlis, P. M., Long, H. C., Quyoum, R., Turner, M. L., & Wang, Z. (1996) · Chemical Communications · doi:10.1039/cc9960000001 · Cited by 112
A DFT study of the chain growth probability in Fischer–Tropsch synthesis
Cheng, J. J., Hu, P., Ellis, P. R., French, S., Kelly, G. J., & LOK, C. (2008) · Journal of Catalysis · doi:10.1016/j.jcat.2008.05.006 · Cited by 102
Spin uncoupling in surface chemisorption of unsaturated hydrocarbons
Triguero, L., Pettersson, L. G. M., Minaev, B. F., et al. (1998) · The Journal of Chemical Physics · doi:10.1063/1.475481 · Cited by 94
Structure sensitivity in the iron single-crystal catalysed synthesis of ammonia
Spencer, N. D., Schoonmaker, R. C., & Somorjai, G. A. (1981) · Nature · doi:10.1038/294643a0 · Cited by 91
Ammonia Dissociation on Pt{100}, Pt{111}, and Pt{211}: A Comparative Density Functional Theory Study
Offermans, W. K., Jansen, A. P. J., van Santen, R. A., Novell-Leruth, G., Ricart, J. M., & Pérez‐Ramírez, J. (2007) · The Journal of Physical Chemistry C · doi:10.1021/jp073083f · Cited by 89
Kliore, A. J., Patel, I. R., Nagy, A. F., Cravens, T. E., & Gombosi, T. I. (1979) · Science · doi:10.1126/science.205.4401.99 · Cited by 88
Ammonia oxidation on a stepped platinum single-crystal surface
Gland, J. L. (1978) · Journal of Catalysis · doi:10.1016/0021-9517(78)90003-9 · Cited by 82
Density-Functional Based Modeling of the Intermediate in the Water Production Reaction on Pt(111)
Karlberg, G. S., & Wahnström, G. (2004) · Physical Review Letters · doi:10.1103/physrevlett.92.136103 · Cited by 76
An interaction model for OH+H2O-mixed and pure H2O overlayers adsorbed on Pt(111)
Karlberg, G. S., & Wahnström, G. (2005) · The Journal of Chemical Physics · doi:10.1063/1.1900088 · Cited by 62
Transition states for NO and CO dissociation on Cu(100) and Cu(111) surfaces
van Daelen, M. A., Li, Y., Newsam, J. M., et al. (1994) · Chemical Physics Letters · doi:10.1016/0009-2614(94)00717-9 · Cited by 40
Density-Functional Theory Study of NHx Oxidation and Reverse Reactions on the Rh(111) Surface
Popa, C., van Santen, R. A., & Jansen, A. P. J. (2007) · The Journal of Physical Chemistry C · doi:10.1021/jp071072g · Cited by 33
Crawford, P. C., & Hu, P. (2006) · The Journal of Physical Chemistry B · doi:10.1021/jp063472u · Cited by 23
Cited by
Electrocatalysis for CO 2 conversion: from fundamentals to value-added products
Wang, G., Chen, J., Ding, Y., Cai, P., Yi, L., Li, Y., Tu, C., Hou, Y., Wen, Z., & Dai, L. (2021) · Chemical Society Reviews · doi:10.1039/d0cs00071j · Cited by 1,295
Centi, G., Quadrelli, E. A., & Perathoner, S. (2013) · Energy & Environmental Science · doi:10.1039/c3ee00056g · Cited by 1,257
Propane dehydrogenation: catalyst development, new chemistry, and emerging technologies
Chen, S., Chang, X., Sun, G., Zhang, T., Xu, Y., Wang, Y., Pei, C., & Gong, J. (2021) · Chemical Society Reviews · doi:10.1039/d0cs00814a · Cited by 895
Machine Learning for Catalysis Informatics: Recent Applications and Prospects
Toyao, T., Maeno, Z., Takakusagi, S., Kamachi, T., Takigawa, I., & Shimizu, K.-I. (2020) · ACS Catalysis · doi:10.1021/acscatal.9b04186 · Cited by 617
Theoretical Heterogeneous Catalysis: Scaling Relationships and Computational Catalyst Design
Greeley, J. (2016) · Annual Review of Chemical and Biomolecular Engineering · doi:10.1146/annurev-chembioeng-080615-034413 · Cited by 409
Metadata
- Authors
- van Santen, R. A., Neurock, M., & Shetty, S. G.
- Venue
- Chemical Reviews
- Publisher
- American Chemical Society (ACS)
- Published
- 2009-12-30
- Volume
- 110
- Issue
- 4
- Pages
- 2005-2048
- ISSN
- 0009-2665 (ISSN-L)
- 1520-6890
- OpenAlex
- W2014907980
- Cited by
- 600
- References
- 83
- FWCI
- 0.67
- Type
- journal article
- Language
- en
- Open access
- closed
About these checks
Registry, retraction, Cites and statistics results are computed, not judged, with one exception: a printed reference that no index lists is read once by a model before it counts as a citation error. Claims are extracted by a model and kept only when their quote appears verbatim in the text; each cited source is then checked, with a model’s help, for whether it says what the claim relies on. Those verdicts can be wrong — read the claim’s quote and the cited source before relying on one.
Statistics and arithmetic are recomputed, not judged.
Confidence bands are shown only for fields calibrated on our annotated test set. None is calibrated yet, so no band is shown.
What counts as a claim ›How we measure confidence ›How we check this ›
Are you an author, or do you see a problem with this page? Request a review
Data sources
Bibliographic data: Semantic Scholar, OpenAlex, Crossref.
Contains information from the Semantic Scholar Academic Graph Datasets, made available under the ODC Attribution License (ODC-BY 1.0).
Semantic Scholar’s data is described in: Kinney, R., et al. (2023). The Semantic Scholar Open Data Platform. arXiv:2301.10140.