Paula Mori‐Sánchez

Physics and Astronomy · Physical Sciences

34h-index20.2kcitations55works0.02yr avg
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Research Topics

Advanced Chemical Physics Studies(39), Spectroscopy and Quantum Chemical Studies(16), Machine Learning in Materials Science(12), Crystallography and molecular interactions(9), Molecular Junctions and Nanostructures(9)

Publications55 total

Response to Comment on “Pushing the frontiers of density functionals by solving the fractional electron problem”
Science·2022· 6 citedOpen Access
Pushing the frontiers of density functionals by solving the fractional electron problem
Science·2021· 373 citedOpen Access
Development of a universal Electron Force Field
APS March Meeting Abstracts·2019
Exact Density Functional Obtained via the Levy Constrained Search
The Journal of Physical Chemistry Letters·2018Open Access
Fermionic Statistics in the Strongly Correlated Limit of Density Functional Theory
Journal of Chemical Theory and Computation·2017Open Access
Exact density functional obtained via the Levy constrained search
arXiv (Cornell University)·2017Open Access
Landscape of an exact energy functional
Physical review. A/Physical review, A·2016· 38 citedOpen Access
The exact density functional for two electrons in one dimension
Bulletin of the American Physical Society·2016
Landscape of the exact energy functional for a simplified universe
Bulletin of the American Physical Society·2016
Local Scaling Correction for Reducing Delocalization Error in Density Functional Approximations
Physical Review Letters·2015· 93 citedOpen Access
Qualitative breakdown of the unrestricted Hartree-Fock energy
The Journal of Chemical Physics·2014· 11 citedOpen Access
Fractional Charge Behavior and Band Gap Predictions with the XYG3 Type of Doubly Hybrid Density Functionals
The Journal of Physical Chemistry A·2014· 50 cited
The derivative discontinuity of the exchange–correlation functional
Physical Chemistry Chemical Physics·2014· 116 citedOpen Access
Derivative discontinuity, bandgap and lowest unoccupied molecular orbital in density functional theory
The Journal of Chemical Physics·2012· 181 citedOpen Access
Failure of the random-phase-approximation correlation energy
Physical Review A·2012· 60 citedOpen Access
Insight and progress in density functional theory
AIP conference proceedings·2012· 3 cited
Challenges for Density Functional Theory
Chemical Reviews·2011· 2.5k cited
Improving Band Gap Prediction in Density Functional Theory from Molecules to Solids
Physical Review Letters·2011· 193 citedOpen Access
A Fractional view of the exchange-correlation functional in density-functional theory
DUGiMedia - Universitat de Girona·2010
Revealing Noncovalent Interactions
Journal of the American Chemical Society·2010· 8.9k cited
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Frequent Co-authors

Aron J. Cohen(28), Weitao Yang(23), Ángel Martín Pendás(12), Vı́ctor Luaña(11), J. M. Recio(8), Aurora Costales(5), L. Gerward(3), M. A. Blanco(3), Erin R. Johnson(2), Julia Contreras‐García(2), James Kirkpatrick(2), Brendan McMorrow(2), David H. P. Turban(2), Alexander L. Gaunt(2), James S. Spencer(2), Annette Obika(2), Louis Thiry(2), Meire Fortunato(2), David Pfau(2), Lara Román Castellanos(2)