| Parameter-free calculations of X-ray spectra with FEFF9 JJ Rehr, JJ Kas, FD Vila, MP Prange, K Jorissen Physical Chemistry Chemical Physics 12 (21), 5503-5513, 2010 | 1224 | 2010 |
| Ab initio theory and calculations of X-ray spectra JJ Rehr, JJ Kas, MP Prange, AP Sorini, Y Takimoto, F Vila Comptes Rendus Physique 10 (6), 548-559, 2009 | 615 | 2009 |
| Bethe-Salpeter equation calculations of core excitation spectra J Vinson, JJ Rehr, JJ Kas, EL Shirley Physical Review B 83 (11), 115106, 2011 | 339 | 2011 |
| Efficient implementation of core-excitation Bethe–Salpeter equation calculations K Gilmore, J Vinson, EL Shirley, D Prendergast, CD Pemmaraju, JJ Kas, ... Computer Physics Communications 197, 109-117, 2015 | 206 | 2015 |
| Valence Electron Photoemission Spectrum of Semiconductors: Ab Initio Description of Multiple Satellites M Guzzo, G Lani, F Sottile, P Romaniello, M Gatti, JJ Kas, JJ Rehr, ... Physical review letters 107 (16), 166401, 2011 | 185 | 2011 |
| Automated generation and ensemble-learned matching of X-ray absorption spectra C Zheng, K Mathew, C Chen, Y Chen, H Tang, A Dozier, JJ Kas, FD Vila, ... npj Computational Materials 4 (1), 12, 2018 | 124 | 2018 |
| Experimental (XAS, STEM, TPR, and XPS) and theoretical (DFT) characterization of supported rhenium catalysts SR Bare, SD Kelly, F D. Vila, E Boldingh, E Karapetrova, J Kas, ... The Journal of Physical Chemistry C 115 (13), 5740-5755, 2011 | 111 | 2011 |
| Cumulant expansion of the retarded one-electron Green function JJ Kas, JJ Rehr, L Reining Physical Review B 90 (8), 085112, 2014 | 105 | 2014 |
| Many-pole model of inelastic losses in x-ray absorption spectra JJ Kas, AP Sorini, MP Prange, LW Cambell, JA Soininen, JJ Rehr Physical Review B 76 (19), 195116, 2007 | 99 | 2007 |
| Dynamic structure in supported Pt nanoclusters: Real-time density functional theory and X-ray spectroscopy simulations F Vila, JJ Rehr, J Kas, RG Nuzzo, AI Frenkel Physical Review B 78 (12), 121404, 2008 | 98 | 2008 |
| Orbital and spin character of doped carriers in infinite-layer nickelates M Rossi, H Lu, A Nag, D Li, M Osada, K Lee, BY Wang, S Agrestini, ... Physical Review B 104 (22), L220505, 2021 | 85 | 2021 |
| Dynamical effects in electron spectroscopy JS Zhou, JJ Kas, L Sponza, I Reshetnyak, M Guzzo, C Giorgetti, M Gatti, ... The Journal of Chemical Physics 143 (18), 2015 | 76 | 2015 |
| Theoretical optical and x-ray spectra of liquid and solid HO J Vinson, JJ Kas, FD Vila, JJ Rehr, EL Shirley Physical Review B 85 (4), 045101, 2012 | 67 | 2012 |
| Ab initio calculations of electron inelastic mean free paths and stopping powers AP Sorini, JJ Kas, JJ Rehr, MP Prange, ZH Levine Physical Review B 74 (16), 165111, 2006 | 65 | 2006 |
| Nonstoichiometric intensities in core photoelectron spectroscopy J Söderström, N Mårtensson, O Travnikova, M Patanen, C Miron, ... Physical Review Letters 108 (19), 193005, 2012 | 64 | 2012 |
| Velocity-gauge real-time TDDFT within a numerical atomic orbital basis set CD Pemmaraju, FD Vila, JJ Kas, SA Sato, JJ Rehr, K Yabana, ... Computer Physics Communications 226, 30-38, 2018 | 60 | 2018 |
| A compact dispersive refocusing Rowland circle X-ray emission spectrometer for laboratory, synchrotron, and XFEL applications WM Holden, OR Hoidn, AS Ditter, GT Seidler, J Kas, JL Stein, BM Cossairt, ... Review of Scientific Instruments 88 (7), 2017 | 58 | 2017 |
| L-edge XANES analysis of photoexcited metal complexes in solution RM Van der Veen, JJ Kas, CJ Milne, VT Pham, A El Nahhas, FA Lima, ... Physical Chemistry Chemical Physics 12 (21), 5551-5561, 2010 | 58 | 2010 |
| Benchmark results and theoretical treatments for valence-to-core x-ray emission spectroscopy in transition metal compounds DR Mortensen, GT Seidler, JJ Kas, N Govind, CP Schwartz, S Pemmaraju, ... Physical Review B 96 (12), 125136, 2017 | 56 | 2017 |
| Polarization dependent high energy resolution X-ray absorption study of dicesium uranyl tetrachloride T Vitova, JC Green, RG Denning, M Löble, K Kvashnina, JJ Kas, ... Inorganic chemistry 54 (1), 174-182, 2015 | 54 | 2015 |
