Semistochastic Heat-Bath Configuration Interaction Method: Selected Configuration Interaction with Semistochastic Perturbation Theory
Sharma, Sandeep, Holmes, Adam A, Jeanmairet, Guillaume, Alavi, Ali, Umrigar, C. J
Published in Journal of chemical theory and computation (11.04.2017)
Published in Journal of chemical theory and computation (11.04.2017)
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Journal Article
Excited states using semistochastic heat-bath configuration interaction
Holmes, Adam A, Umrigar, C J, Sharma, Sandeep
Published in The Journal of chemical physics (28.10.2017)
Published in The Journal of chemical physics (28.10.2017)
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Journal Article
Fast semistochastic heat-bath configuration interaction
Li, Junhao, Otten, Matthew, Holmes, Adam A, Sharma, Sandeep, Umrigar, C J
Published in The Journal of chemical physics (07.12.2018)
Published in The Journal of chemical physics (07.12.2018)
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Journal Article
The Ground State Electronic Energy of Benzene
Eriksen, Janus J, Anderson, Tyler A, Deustua, J. Emiliano, Ghanem, Khaldoon, Hait, Diptarka, Hoffmann, Mark R, Lee, Seunghoon, Levine, Daniel S, Magoulas, Ilias, Shen, Jun, Tubman, Norm M, Whaley, K. Birgitta, Xu, Enhua, Yao, Yuan, Zhang, Ning, Alavi, Ali, Chan, Garnet Kin-Lic, Head-Gordon, Martin, Liu, Wenjian, Piecuch, Piotr, Sharma, Sandeep, Ten-no, Seiichiro L, Umrigar, C. J, Gauss, Jürgen
Published in The journal of physical chemistry letters (15.10.2020)
Published in The journal of physical chemistry letters (15.10.2020)
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Journal Article
Efficient Heat-Bath Sampling in Fock Space
Holmes, Adam A, Changlani, Hitesh J, Umrigar, C. J
Published in Journal of chemical theory and computation (12.04.2016)
Published in Journal of chemical theory and computation (12.04.2016)
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Journal Article
Externally Corrected CCSD with Renormalized Perturbative Triples (R-ecCCSD(T)) and the Density Matrix Renormalization Group and Selected Configuration Interaction External Sources
Lee, Seunghoon, Zhai, Huanchen, Sharma, Sandeep, Umrigar, C. J, Chan, Garnet Kin-Lic
Published in Journal of chemical theory and computation (08.06.2021)
Published in Journal of chemical theory and computation (08.06.2021)
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Journal Article
Semistochastic projector Monte Carlo method
Petruzielo, F R, Holmes, A A, Changlani, Hitesh J, Nightingale, M P, Umrigar, C J
Published in Physical review letters (04.12.2012)
Published in Physical review letters (04.12.2012)
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Journal Article
Alleviation of the Fermion-sign problem by optimization of many-body wave functions
Umrigar, C J, Toulouse, Julien, Filippi, Claudia, Sorella, S, Hennig, R G
Published in Physical review letters (16.03.2007)
Published in Physical review letters (16.03.2007)
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Journal Article
Excited States of Methylene, Polyenes, and Ozone from Heat-Bath Configuration Interaction
Chien, Alan D, Holmes, Adam A, Otten, Matthew, Umrigar, C. J, Sharma, Sandeep, Zimmerman, Paul M
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (15.03.2018)
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (15.03.2018)
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Journal Article
Correlation-induced inhomogeneity in circular quantum dots
Ghosal, Amit, Baranger, Harold U, Güçlü, A. D, Umrigar, C. J, Ullmo, Denis
Published in Nature physics (01.05.2006)
Published in Nature physics (01.05.2006)
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Journal Article
The Chromium Dimer: Closing a Chapter of Quantum Chemistry
Larsson, Henrik R., Zhai, Huanchen, Umrigar, C. J., Chan, Garnet Kin-Lic
Published in Journal of the American Chemical Society (07.09.2022)
Published in Journal of the American Chemical Society (07.09.2022)
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Journal Article
Reducing the time-step errors in diffusion Monte Carlo
Anderson, Tyler A, Per, Manolo C, Umrigar, C J
Published in The Journal of chemical physics (14.03.2024)
Published in The Journal of chemical physics (14.03.2024)
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