Martin Head-Gordon, PhD

University of California, Berkeley, Berkeley, CA, United States 
Theoretical Chemistry
"Martin Head-Gordon"

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Greg Beran grad student UC Riverside
Kristina D. Closser grad student
Yi-Pei Li grad student UC Berkeley
Christopher A White grad student 1993-1997
Edward F. Byrd grad student 2001 UC Berkeley
Troy A. Van Voorhis grad student 2001 UC Berkeley
Yihan Shao grad student 2002 UC Berkeley
Jennifer L. Weisman grad student 2003 UC Berkeley
Gregory J. Beran grad student 2005 UC Berkeley
Yousung Jung grad student 2005 UC Berkeley
Anthony D. Dutoi grad student 2006 UC Berkeley
Rohini C. Lochan grad student 2006 UC Berkeley
Joseph E. Subotnik grad student 2006 UC Berkeley
Rustam Z. Khaliullin grad student 2007 UC Berkeley
Alexander J. Sodt grad student 2007 UC Berkeley
Ryan P. Steele grad student 2008 UC Berkeley
Frank L. Yip grad student 2008 UC Berkeley
Anthony J. Goodrow grad student 2009 UC Berkeley
Keith V. Lawler grad student 2009 UC Berkeley
Robert A. DiStasio Jr. grad student 2004-2009 UC Berkeley
John A. Parkhill grad student 2005-2010 UC Berkeley
Westin Kurlancheek grad student 2011 UC Berkeley
Franziska Bell grad student 2012 UC Berkeley
Matthew B. Goldey grad student 2014 UC Berkeley
Eric J. Sundstrom grad student 2014 UC Berkeley
Shaama Mallikarjun Sharada grad student 2010-2015
Yuezhi Mao grad student 2012-2017 UC Berkeley
Romit Chakraborty post-doc UC Berkeley
Jason D. Goodpaster post-doc UC Berkeley
Chao-Ping (Cherri) Hsu post-doc
Jose L Mendoza-Cortes post-doc
Roberto Peverati post-doc
Ehud Tsivion post-doc 2013- chemistry
James Shee post-doc 2019- UC Berkeley
Christian Ochsenfeld post-doc 1995-1998 UC Berkeley
Anna I. Krylov post-doc 1996-1998 UC Berkeley
Roi Baer post-doc 1997-1998 UC Berkeley
C. David Sherrill post-doc 1996-1999 UC Berkeley
So Hirata post-doc 1998-1999 UC Berkeley
Steven R. Gwaltney post-doc 1998-2002 UC Berkeley
Garnet K.L. Chan post-doc 2000-2002 UC Berkeley
Andreas Dreuw post-doc 2001-2003 UC Berkeley
John M. Herbert post-doc 2006 UC Berkeley
Alán Aspuru-Guzik post-doc 2005-2006 UC Berkeley
Young M. Rhee post-doc 2008 UC Berkeley
Jeng-Da Chai post-doc 2006-2009 UC Berkeley
Daniel S. Lambrecht post-doc 2012 UC Berkeley
Paul M. Zimmerman post-doc 2010-2012 UC Berkeley
Eleonora Luppi post-doc 2011-2012 UC Berkeley
Evgeny Epifanovskiy post-doc 2011-2014
Nicholas J. Mayhall post-doc 2011-2015 UC Berkeley
Susi Lehtola post-doc 2014-2017 Lawrence Berkeley National Lab, UC Berkeley
Xintin Feng post-doc 2016-2018
Zhou Lin post-doc 2018-2020 LBNL/UC Berkeley
Joseph A Gauthier post-doc 2020-2021 LBNL/UC Berkeley
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Ganoe B, Head-Gordon M. (2023) Doubles Connected Moments Expansion: A Tractable Approximate Horn-Weinstein Approach for Quantum Chemistry. Journal of Chemical Theory and Computation. 19: 9187-9201
Carter-Fenk K, Shee J, Head-Gordon M. (2023) Optimizing the regularization in size-consistent second-order Brillouin-Wigner perturbation theory. The Journal of Chemical Physics. 159
Carter-Fenk K, Liu M, Pujal L, et al. (2023) The Energetic Origins of Pi-Pi Contacts in Proteins. Journal of the American Chemical Society
Wang Z, Aldossary A, Shi T, et al. (2023) Local Second-Order Møller-Plesset Theory with a Single Threshold Using Orthogonal Virtual Orbitals: Theory, Implementation, and Assessment. Journal of Chemical Theory and Computation
Motta M, Sung KJ, Whaley KB, et al. (2023) Bridging physical intuition and hardware efficiency for correlated electronic states: the local unitary cluster Jastrow ansatz for electronic structure. Chemical Science. 14: 11213-11227
Li WL, Chen K, Rossomme E, et al. (2023) Greater transferability and accuracy of norm-conserving pseudopotentials using nonlinear core corrections. Chemical Science. 14: 10934-10943
Di Felice R, Mayes ML, Richard RM, et al. (2023) A Perspective on Sustainable Computational Chemistry Software Development and Integration. Journal of Chemical Theory and Computation
Zhang W, Walser-Kuntz R, Tracy JS, et al. (2023) Indolo[2,3-]quinoxaline as a Low Reduction Potential and High Stability Anolyte Scaffold for Nonaqueous Redox Flow Batteries. Journal of the American Chemical Society. 145: 18877-18887
Carter-Fenk K, Head-Gordon M. (2023) Repartitioned Brillouin-Wigner perturbation theory with a size-consistent second-order correlation energy. The Journal of Chemical Physics. 158
Talbot JJ, Chakraborty R, Shen H, et al. (2023) A Free Energy Decomposition Analysis: Insight into Binding Thermodynamics from Absolutely Localized Molecular Orbitals. The Journal of Physical Chemistry Letters. 14: 5432-5440
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