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A

Andrew Wildman

sandboxaq support team

13H-index
31Paper Count
547Citation Count
Published Papers 10
Publication Date
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AQCat25: unlocking spin-aware, high-fidelity machine learning potentials for heterogeneous catalysis
errnpj Computational Materials
IF11.9
err2026-04-27
err0
errOAAI
errOmar Allam; Brook Wander; SungYeon Kim; Rudi Plesch; Tyler Sours; Jia-Min Chu; Thomas Ludwig; Jiyoon Kim; Rodrigo Wang; Shivang Agarwal; Alan Rask; Alexandre Fleury; Chuhong Wang; Andrew Wildman; Thomas Mustard; Kevin Ryczko; Paul Abruzzo; AJ Nish; Aayush R. Singh
errShare
errSave
Breaking Down Per- and Polyfluoroalkyl Substances (PFAS): Tackling Multitudes of Correlated Electrons
errChem. Sci.
IF7.4
err2025-08-22
err0
errOAAI
errAlan E Rask; Lee Huntington; SungYeon Kim; David Walker; Andrew Wildman; Rodrigo Wang; Nicole Hazel; Alan Judi; James T Pegg; Punit K Jha; Zara Mayimfor; Carl Dukatz; Hassan Naseri; Ilan Gleiser; Maxime R Hugues; Paul Zimmerman; Arman Zaribafiyan; Rudi Plesch; Takeshi Yamazaki
errShare
errSave
Solvated Nuclear-Electronic Orbital Structure and Dynamics (vol 18, pg 1340, 2022)
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2022-12-07
err0
PREAI
errWildman, Andrew; Tao, Zhen; Zhao, Luning; Hammes-Schiffer, Sharon; Li, Xiaosong
errShare
errSave
Solvated Nuclear-Electronic Orbital Structure and Dynamics
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2022-02-18
err10
errOAAI
errWildman, Andrew; Tao, Zhen; Zhao, Luning; Hammes-Schiffer, Sharon; Li, Xiaosong
errShare
errSave
Interplays of electron and nuclear motions along CO dissociation trajectory in myoglobin revealed by ultrafast X-rays and quantum dynamics calculations
errPROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA
IF9.1
err2021-03-29
err10
errOAAI
errShelby, Megan L.; Wildman, Andrew; Hayes, Dugan; Mara, Michael W.; Lestrange, Patrick J.; Cammarata, Marco; Balducci, Lodovico; Artamonov, Maxim; Lemke, Henrik T.; Zhu, Diling; Seideman, Tamar; Hoffman, Brian M.; Li, Xiaosong; Chen, Lin X.
errShare
errSave
Generalization of Block-Localized Wave Function for Constrained Optimization of Excited Determinants
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2020-12-24
err22
PREAI
errGrofe, Adam; Zhao, Ruoqi; Wildman, Andrew; Stetina, Torin F.; Li, Xiaosong; Bao, Peng; Gao, Jiali
errShare
errSave
Nuclear-electronic orbital Ehrenfest dynamics
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2020-12-09
err41
PREAI
errZhao, Luning; Wildman, Andrew; Tao, Zhen; Schneider, Patrick; Hammes-Schiffer, Sharon; Li, Xiaosong
errShare
errSave
The Chronus Quantum software package
errWILEY INTERDISCIPLINARY REVIEWS-COMPUTATIONAL MOLECULAR SCIENCE
IF27
err2019-09-10
err91
errOAAI
errWilliams-Young, David B.; Petrone, Alessio; Sun, Shichao; Stetina, Torin F.; Lestrange, Patrick; Hoyer, Chad E.; Nascimento, Daniel R.; Koulias, Lauren; Wildman, Andrew; Kasper, Joseph; Goings, Joshua J.; Ding, Feizhi; DePrince, A. Eugene, III; Valeev, Edward F.; Li, Xiaosong
errShare
errSave
Time-Dependent Complete Active Space Embedded in a Polarizable Force Field
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2019-01-28
err21
errOAAI
errLiu, Hongbin; Jenkins, Andrew J.; Wildman, Andrew; Frisch, Michael J.; Lipparini, Filippo; Mennucci, Benedetta; Li, Xiaosong
errShare
errSave
Nonequilibrium Environment Dynamics in a Frequency-Dependent Polarizable Embedding Model
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2018-12-04
err25
PREAI
errWildman, Andrew; Donati, Greta; Lipparini, Filippo; Mennucci, Benedetta; Li, Xiaosong
errShare
errSave

Research Directions

No research directions
Co-authors
Cooperation Journals
M
Michael J. Frisch
H-index: 98 · Papers: 354
B
Brian M. Hoffman
H-index: 95 · Papers: 896
B
Benedetta Mennucci
H-index: 84 · Papers: 566
S
Sharon Hammes‐Schiffer
H-index: 83 · Papers: 679
J
Jiali Gao
H-index: 82 · Papers: 428
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