Concepedia

Alec F. White

AF

Statistics

Publications

22

Citations

6.5K

H-Index

18

Active since

2014

Affiliations

Lawrence Berkeley National Laboratory(Current)

University of California, Berkeley

California Institute of Technology

University of California, Davis

Simulation Technologies (United States)

Alec F. White is an author at Lawrence Berkeley National Laboratory specializing in natural sciences, chemistry, and ab initio methods.

ORCID

Publications per year

2014–2025

22

Publications

22

Advances in molecular quantum chemistry contained in the Q-Chem 4 program package

Yihan Shao, Zhengting Gan, Evgeny Epifanovsky et al. · Molecular Physics · 2014 · 3.1K citations

, , +17

Software for the frontiers of quantum chemistry: An overview of developments in the Q-Chem 5 package

Evgeny Epifanovsky, Andrew T. B. Gilbert, Xintian Feng et al. · The Journal of Chemical Physics · 2021 · 1.3K citations · Full text

, , +17

Recent developments in the P<scp>y</scp>SCF program package

Qiming Sun, Xing Zhang, Samragni Banerjee et al. · The Journal of Chemical Physics · 2020 · 1.2K citations · Full text

, , +17

Reliably assessing the electronic structure of cytochrome P450 on today’s classical computers and tomorrow’s quantum computers

Joshua J. Goings, Alec F. White, Joonho Lee et al. · Proceedings of the National Academy of Sciences · 2022 · 133 citations · Full text

, , +17

Non-orthogonal configuration interaction with single substitutions for the calculation of core-excited states

Katherine J. Oosterbaan, Alec F. White, Martin Head‐Gordon · The Journal of Chemical Physics · 2018 · 77 citations · Full text

, , +17

1–5 of 22