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Paul J. Robinson
Paul J. Robinson
Email verificata su fas.harvard.edu
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Recent developments in the PySCF program package
Q Sun, X Zhang, S Banerjee, P Bao, M Barbry, NS Blunt, NA Bogdanov, ...
The Journal of chemical physics 153 (2), 2020
6122020
The significance of polarons and dynamic disorder in halide perovskites
MJ Schilcher, PJ Robinson, DJ Abramovitch, LZ Tan, AM Rappe, ...
ACS Energy Letters 6 (6), 2162-2173, 2021
962021
Mystery of three borides: Differential metal–boron bonding governing superhard structures
PJ Robinson, G Liu, S Ciborowski, C Martinez-Martinez, JR Chamorro, ...
Chemistry of Materials 29 (23), 9892-9896, 2017
502017
SmB6 Cluster Anion: Covalency Involving f Orbitals
PJ Robinson, X Zhang, T McQueen, KH Bowen, AN Alexandrova
The Journal of Physical Chemistry A 121 (8), 1849-1854, 2017
382017
Excitation variance matching with limited configuration interaction expansions in variational Monte Carlo
PJ Robinson, SD Pineda Flores, E Neuscamman
The Journal of Chemical Physics 147 (16), 2017
322017
Photoelectron spectroscopic and theoretical study of the [HPd (η2-H2)]− cluster anion
X Zhang, PJ Robinson, G Ganteför, A Alexandrova, KH Bowen
The Journal of chemical physics 143 (9), 2015
302015
Assessing the bonding properties of individual molecular orbitals
PJ Robinson, AN Alexandrova
The Journal of Physical Chemistry A 119 (51), 12862-12867, 2015
212015
Dynamical bonding driving mixed valency in a metal boride
PJ Robinson, J Munarriz, ME Valentine, A Granmoe, N Drichko, ...
Angewandte Chemie 132 (27), 11089-11095, 2020
122020
Cumulant methods for electron-phonon problems. I. Perturbative expansions
PJ Robinson, IS Dunn, DR Reichman
Physical Review B 105 (22), 224304, 2022
112022
Cumulant methods for electron-phonon problems. II. The self-consistent cumulant expansion
PJ Robinson, IS Dunn, DR Reichman
Physical Review B 105 (22), 224305, 2022
112022
Understanding How Bonding Controls Strength Anisotropy in Hard Materials by Comparing the High-Pressure Behavior of Orthorhombic and Tetragonal Tungsten Monoboride
J Lei, MT Yeung, PJ Robinson, R Mohammadi, CL Turner, J Yan, ...
The Journal of Physical Chemistry C 122 (10), 5647-5656, 2018
112018
Towards a single chemical model for understanding lanthanide hexaborides
J Munarriz, PJ Robinson, AN Alexandrova
Angewandte Chemie 132 (50), 22873-22878, 2020
32020
Structure and dynamics of electron-phonon coupled systems using neural quantum states
A Mahajan, PJ Robinson, J Lee, DR Reichman
arXiv preprint arXiv:2405.08701, 2024
2024
Ab Initio Polaron Wave Functions
PJ Robinson, J Lee, A Mahajan, DR Reichman
arXiv preprint arXiv:2405.08700, 2024
2024
Hardening in Tungsten Tetraboride with the Addition of Carbon, Zirconium, and Silicon: Intrinsic vs Extrinsic Effects
G Akopov, S Hu, KD Shumilov, SG Hamilton, LE Pangilinan, ...
Chemistry of Materials 36 (7), 3233-3245, 2024
2024
Condensed-Phase Quantum Chemistry
PJ Robinson, A Rettig, HQ Dinh, MF Chen, J Lee
arXiv preprint arXiv:2403.13207, 2024
2024
Structure and Dynamics in Electron-Phonon Coupled Materials
PJP Robinson
Columbia University, 2023
2023
Il sistema al momento non può eseguire l'operazione. Riprova più tardi.
Articoli 1–17