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Nature Computational Science
|
October 10, 2024
Bridging the gap in electronic structure calculations via machine learning
Attila Cangi
Scientific Reports
|
January 21, 2022
Thermal excitation signals in the inhomogeneous warm dense electron gas
Zhandos A Moldabekov, Tobias Dornheim, Attila Cangi
Physical Review Letters
|
July 23, 2008
Semiclassical origins of density functionals
Peter Elliott, Donghyung Lee, Attila Cangi, et al.
The Journal of Chemical Physics
|
October 2, 2021
The relevance of electronic perturbations in the warm dense electron gas
Zhandos Moldabekov, Tobias Dornheim, Maximilian Böhme, et al.
The Journal of Chemical Physics
|
July 1, 2022
Effective electronic forces and potentials from ab initio path integral Monte Carlo simulations
Tobias Dornheim, Panagiotis Tolias, Zhandos A Moldabekov, et al.
The Journal of Chemical Physics
|
March 8, 2023
Assessing the accuracy of hybrid exchange-correlation functionals for the density response of warm dense electrons
Zhandos A Moldabekov, Mani Lokamani, Jan Vorberger, et al.
Physical Review Letters
|
February 21, 2015
Corrections to Thomas-Fermi densities at turning points and beyond
Raphael F Ribeiro, Donghyung Lee, Attila Cangi, et al.
The Journal of Chemical Physics
|
December 4, 2025
Scalable machine learning model for energy decomposition analysis in aqueous systems
Hossein Tahmasbi, Michael Beerbaum, Bartosz Brzoza, et al.
The Journal of Physical Chemistry Letters
|
February 1, 2023
Non-empirical Mixing Coefficient for Hybrid XC Functionals from Analysis of the XC Kernel
Zhandos A Moldabekov, Mani Lokamani, Jan Vorberger, et al.
Physical Review Letters
|
July 21, 2011
Electronic structure via potential functional approximations
Attila Cangi, Donghyung Lee, Peter Elliott, et al.
Page
of 2
Search research articles
Search
Showing results (1-10 of 12) with videos related to
Sort By:
Page
of 2
Nature Computational Science
|
October 10, 2024
Bridging the gap in electronic structure calculations via machine learning
Attila Cangi
Scientific Reports
|
January 21, 2022
Thermal excitation signals in the inhomogeneous warm dense electron gas
Zhandos A Moldabekov, Tobias Dornheim, Attila Cangi
Physical Review Letters
|
July 23, 2008
Semiclassical origins of density functionals
Peter Elliott, Donghyung Lee, Attila Cangi, et al.
The Journal of Chemical Physics
|
October 2, 2021
The relevance of electronic perturbations in the warm dense electron gas
Zhandos Moldabekov, Tobias Dornheim, Maximilian Böhme, et al.
The Journal of Chemical Physics
|
July 1, 2022
Effective electronic forces and potentials from ab initio path integral Monte Carlo simulations
Tobias Dornheim, Panagiotis Tolias, Zhandos A Moldabekov, et al.
The Journal of Chemical Physics
|
March 8, 2023
Assessing the accuracy of hybrid exchange-correlation functionals for the density response of warm dense electrons
Zhandos A Moldabekov, Mani Lokamani, Jan Vorberger, et al.
Physical Review Letters
|
February 21, 2015
Corrections to Thomas-Fermi densities at turning points and beyond
Raphael F Ribeiro, Donghyung Lee, Attila Cangi, et al.
The Journal of Chemical Physics
|
December 4, 2025
Scalable machine learning model for energy decomposition analysis in aqueous systems
Hossein Tahmasbi, Michael Beerbaum, Bartosz Brzoza, et al.
The Journal of Physical Chemistry Letters
|
February 1, 2023
Non-empirical Mixing Coefficient for Hybrid XC Functionals from Analysis of the XC Kernel
Zhandos A Moldabekov, Mani Lokamani, Jan Vorberger, et al.
Physical Review Letters
|
July 21, 2011
Electronic structure via potential functional approximations
Attila Cangi, Donghyung Lee, Peter Elliott, et al.
Page
of 2