Các bài viết có thể truy cập công khai - Paula Mori-SanchezTìm hiểu thêm
Không có ở bất kỳ nơi nào: 1
Fractional charge behavior and band gap predictions with the XYG3 type of doubly hybrid density functionals
NQ Su, W Yang, P Mori-Sanchez, X Xu
The Journal of Physical Chemistry A 118 (39), 9201-9211, 2014
Các cơ quan ủy nhiệm: National Natural Science Foundation of China, Government of Spain
Có tại một số nơi: 12
Revealing noncovalent interactions
ER Johnson, S Keinan, P Mori-Sánchez, J Contreras-García, AJ Cohen, ...
Journal of the American Chemical Society 132 (18), 6498-6506, 2010
Các cơ quan ủy nhiệm: US National Institutes of Health
Challenges for density functional theory
AJ Cohen, P Mori-Sánchez, W Yang
Chemical reviews 112 (1), 289-320, 2012
Các cơ quan ủy nhiệm: Government of Spain
Improving band gap prediction in density functional theory from molecules to solids
X Zheng, AJ Cohen, P Mori-Sánchez, X Hu, W Yang
Physical review letters 107 (2), 026403, 2011
Các cơ quan ủy nhiệm: Government of Spain
Derivative discontinuity, bandgap and lowest unoccupied molecular orbital in density functional theory
W Yang, AJ Cohen, P Mori-Sanchez
The Journal of chemical physics 136 (20), 2012
Các cơ quan ủy nhiệm: Government of Spain
The derivative discontinuity of the exchange–correlation functional
P Mori-Sánchez, AJ Cohen
Physical Chemistry Chemical Physics 16 (28), 14378-14387, 2014
Các cơ quan ủy nhiệm: Government of Spain
Local scaling correction for reducing delocalization error in density functional approximations
C Li, X Zheng, AJ Cohen, P Mori-Sánchez, W Yang
Physical review letters 114 (5), 053001, 2015
Các cơ quan ủy nhiệm: Chinese Academy of Sciences, National Natural Science Foundation of China …
Failure of the random-phase-approximation correlation energy
P Mori-Sánchez, AJ Cohen, W Yang
Physical Review A—Atomic, Molecular, and Optical Physics 85 (4), 042507, 2012
Các cơ quan ủy nhiệm: Government of Spain
Landscape of an exact energy functional
AJ Cohen, P Mori-Sánchez
Physical Review A 93 (4), 042511, 2016
Các cơ quan ủy nhiệm: Government of Spain
Dramatic changes in electronic structure revealed by fractionally charged nuclei
AJ Cohen, P Mori-Sánchez
The Journal of Chemical Physics 140 (4), 2014
Các cơ quan ủy nhiệm: Government of Spain
Fermionic statistics in the strongly correlated limit of Density Functional Theory
J Grossi, DP Kooi, KJH Giesbertz, M Seidl, AJ Cohen, P Mori-Sánchez, ...
Journal of chemical theory and computation 13 (12), 6089-6100, 2017
Các cơ quan ủy nhiệm: European Commission, Government of Spain
Exact density functional obtained via the Levy constrained search
P Mori-Sánchez, AJ Cohen
The journal of physical chemistry letters 9 (17), 4910-4914, 2018
Các cơ quan ủy nhiệm: Government of Spain
Qualitative breakdown of the unrestricted Hartree-Fock energy
P Mori-Sánchez, AJ Cohen
The Journal of Chemical Physics 141 (16), 2014
Các cơ quan ủy nhiệm: Government of Spain
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