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The Journal of Chemical Physics
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May 9, 2025
Assessment of RPA and σ-functional methods for the calculation of dipole moments and static polarizabilities and hyperpolarizabilities
Raviraj Mandalia, Steffen Fauser, Egor Trushin, et al.
The Journal of Chemical Physics
|
October 9, 2021
Chemical accuracy with σ-functionals for the Kohn-Sham correlation energy optimized for different input orbitals and eigenvalues
Steffen Fauser, Egor Trushin, Christian Neiss, et al.
The Journal of Chemical Physics
|
September 22, 2022
Scaled σ-functionals for the Kohn-Sham correlation energy with scaling functions from the homogeneous electron gas
Jannis Erhard, Steffen Fauser, Egor Trushin, et al.
Physical Review Letters
|
February 6, 2025
Accurate Correlation Potentials from the Self-Consistent Random Phase Approximation
Egor Trushin, Steffen Fauser, Andreas Mölkner, et al.
Physical Review Letters
|
July 31, 2025
Trushin et al. Reply
Egor Trushin, Steffen Fauser, Andreas Mölkner, et al.
The Journal of Chemical Physics
|
December 9, 2025
Mixed Gaussian and plane wave basis set implementation of the random phase approximation and of σ-functionals within the program package CP2K
Raviraj Mandalia, Egor Trushin, Frederick Stein, et al.
Faraday Discussions
|
September 16, 2020
Lieb-Oxford bound and pair correlation functions for density-functional methods based on the adiabatic-connection fluctuation-dissipation theorem
Jannis Erhard, Steffen Fauser, Simon Kalaß, et al.
Journal of Chemical Theory and Computation
|
March 11, 2024
Basis Set Requirements of σ-Functionals for Gaussian- and Slater-Type Basis Functions and Comparison with Range-Separated Hybrid and Double Hybrid Functionals
Steffen Fauser, Arno Förster, Leon Redeker, et al.
Proceedings of the National Academy of Sciences of the United States of America
|
March 8, 2017
Understanding band gaps of solids in generalized Kohn-Sham theory
John P Perdew, Weitao Yang, Kieron Burke, et al.
Page
of 2
Search research articles
Search
Showing results (11-20 of 19) with videos related to
Sort By:
Page
of 2
You have reached the last page of results.
This site can display upto 19 results.
The Journal of Chemical Physics
|
May 9, 2025
Assessment of RPA and σ-functional methods for the calculation of dipole moments and static polarizabilities and hyperpolarizabilities
Raviraj Mandalia, Steffen Fauser, Egor Trushin, et al.
The Journal of Chemical Physics
|
October 9, 2021
Chemical accuracy with σ-functionals for the Kohn-Sham correlation energy optimized for different input orbitals and eigenvalues
Steffen Fauser, Egor Trushin, Christian Neiss, et al.
The Journal of Chemical Physics
|
September 22, 2022
Scaled σ-functionals for the Kohn-Sham correlation energy with scaling functions from the homogeneous electron gas
Jannis Erhard, Steffen Fauser, Egor Trushin, et al.
Physical Review Letters
|
February 6, 2025
Accurate Correlation Potentials from the Self-Consistent Random Phase Approximation
Egor Trushin, Steffen Fauser, Andreas Mölkner, et al.
Physical Review Letters
|
July 31, 2025
Trushin et al. Reply
Egor Trushin, Steffen Fauser, Andreas Mölkner, et al.
The Journal of Chemical Physics
|
December 9, 2025
Mixed Gaussian and plane wave basis set implementation of the random phase approximation and of σ-functionals within the program package CP2K
Raviraj Mandalia, Egor Trushin, Frederick Stein, et al.
Faraday Discussions
|
September 16, 2020
Lieb-Oxford bound and pair correlation functions for density-functional methods based on the adiabatic-connection fluctuation-dissipation theorem
Jannis Erhard, Steffen Fauser, Simon Kalaß, et al.
Journal of Chemical Theory and Computation
|
March 11, 2024
Basis Set Requirements of σ-Functionals for Gaussian- and Slater-Type Basis Functions and Comparison with Range-Separated Hybrid and Double Hybrid Functionals
Steffen Fauser, Arno Förster, Leon Redeker, et al.
Proceedings of the National Academy of Sciences of the United States of America
|
March 8, 2017
Understanding band gaps of solids in generalized Kohn-Sham theory
John P Perdew, Weitao Yang, Kieron Burke, et al.
Page
of 2