| From the Sabatier principle to a predictive theory of transition-metal heterogeneous catalysis AJ Medford, A Vojvodic, JS Hummelshøj, J Voss, F Abild-Pedersen, ... Journal of Catalysis 328, 36-42, 2015 | 1514 | 2015 |
| Interfacial Challenges in Solid-State Li Ion Batteries AC Luntz, J Voss, K Reuter The Journal of Physical Chemistry Letters 6, 4599–4604, 2015 | 456 | 2015 |
| Effects of d-band shape on the surface reactivity of transition-metal alloys H Xin, A Vojvodic, J Voss, JK Nørskov, F Abild-Pedersen Physical Review B 89 (11), 115114, 2014 | 450 | 2014 |
| High-Pressure Single-Crystal Structures of 3D Lead-Halide Hybrid Perovskites and Pressure Effects on their Electronic and Optical Properties A Jaffe, Y Lin, CM Beavers, J Voss, WL Mao, HI Karunadasa ACS Central Science, 2016 | 404 | 2016 |
| Mechanisms of two-electron and four-electron electrochemical oxygen reduction reactions at nitrogen-doped reduced graphene oxide HW Kim, VJ Bukas, H Park, S Park, KM Diederichsen, J Lim, YH Cho, ... ACS Catalysis 10, 852-863, 2020 | 205 | 2020 |
| Tunneling and Polaron Charge Transport through Li2O2 in Li–O2 Batteries AC Luntz, V Viswanathan, J Voss, JB Varley, JK Nørskov, R Scheffler, ... The Journal of Physical Chemistry Letters 4 (20), 3494-3499, 2013 | 196 | 2013 |
| High-throughput screening of solid-state Li-ion conductors using lattice-dynamics descriptors S Muy, J Voss, R Schlem, R Koerver, SJ Sedlmaier, F Maglia, P Lamp, ... ISCIENCE 16, 270-282, 2019 | 158 | 2019 |
| Structural stability and decomposition of Mg (BH4) 2 isomorphs—an ab initio free energy study J Voss, JS Hummelshøj, Z Łodziana, T Vegge Journal of Physics: Condensed Matter 21 (1), 012203, 2008 | 96 | 2008 |
| Li+ defects in a solid-state Li ion battery: theoretical insights with a Li3OCl electrolyte S Stegmaier, J Voss, K Reuter, AC Luntz Chem. Mater., 2017 | 94 | 2017 |
| Density functional theory based screening of ternary alkali-transition metal borohydrides: A computational material design project JS Hummelshøj, DD Landis, J Voss, T Jiang, A Tekin, N Bork, M Dułak, ... The Journal of chemical physics 131 (1), 2009 | 84 | 2009 |
| Hydrodeoxygenation of phenol to benzene and cyclohexane on Rh (111) and Rh (211) surfaces: insights from density functional theory D Garcia-Pintos, J Voss, AD Jensen, F Studt The Journal of Physical Chemistry C 120 (33), 18529-18537, 2016 | 71 | 2016 |
| Theoretical Investigations of the Electrochemical Reduction of CO on Single Metal Atoms Embedded in Graphene C Kirk, L Chen, S Siahrostami, R Karamad, M Bajdich, J Voss, J Nørskov, ... ACS Cent. Sci., 2017 | 63 | 2017 |
| An orbital-overlap model for minimal work functions of cesiated metal surfaces SH Chou, J Voss, I Bargatin, A Vojvodic, RT Howe, F Abild-Pedersen Journal of Physics: Condensed Matter 24 (44), 445007, 2012 | 63 | 2012 |
| Adsorption on transition metal surfaces: Transferability and accuracy of DFT using the ADS41 dataset S Mallikarjun Sharada, RKB Karlsson, Y Maimaiti, J Voss, T Bligaard Phys. Rev. B 100, 035439, 2019 | 62 | 2019 |
| Combining experiment and theory to unravel the mechanism of two-electron oxygen reduction at a selective and active co-catalyst VJ Bukas, HW Kim, R Sengpiel, K Knudsen, J Voss, BD McCloskey, ... ACS Catalysis 8 (12), 11940-11951, 2018 | 51 | 2018 |
| mBEEF-vdW: Robust fitting of error estimation density functionals KT Lundgaard, J Wellendorff, J Voss, KW Jacobsen, T Bligaard Physical Review B 93 (23), 235162, 2016 | 50 | 2016 |
| Multi-ion Conduction in Li3OCl Glass Electrolytes HH Heenen, J Voss, C Scheurer, K Reuter, AC Luntz The Journal of Physical Chemistry Letters 10, 2264-2269, 2019 | 47 | 2019 |
| Hydrogen Dynamics in Na3AlH6: A Combined Density Functional Theory and Quasielastic Neutron Scattering Study J Voss, Q Shi, HS Jacobsen, M Zamponi, K Lefmann, T Vegge The Journal of Physical Chemistry B 111 (15), 3886-3892, 2007 | 43 | 2007 |
| Point defect dynamics in sodium aluminum hydrides—A combined quasielastic neutron scattering and density functional theory study Q Shi, J Voss, HS Jacobsen, K Lefmann, M Zamponi, T Vegge Journal of alloys and compounds 446, 469-473, 2007 | 37 | 2007 |
| Specific Reaction Parameter Density Functional Based on the Meta-Generalized Gradient Approximation: Application to H2 + Cu(111) and H2 + Ag(111) EWF Smeets, J Voss, GJ Kroes Journal of Physical Chemistry A 123 (25), 5395-5406, 2019 | 36 | 2019 |
Frank Abild-PedersenSenior Staff Scientist SLAC National Accelerator LaboratoryVerified email at slac.stanford.edu
