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The Journal of Physical Chemistry. A
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February 11, 2022
Quantification of Geometric Errors Made Simple: Application to Main-Group Molecular Structures
Stefan Vuckovic
Journal of Chemical Theory and Computation
|
May 15, 2019
Density Functionals from the Multiple-Radii Approach: Analysis and Recovery of the Kinetic Correlation Energy
Stefan Vuckovic
Nature Computational Science
|
January 4, 2024
Using AI to navigate through the DFA zoo
Stefan Vuckovic
Journal of Chemical Theory and Computation
|
August 23, 2023
Nonlocal Functionals Inspired by the Strongly Interacting Limit of DFT: Exact Constraints and Implementation
Stefan Vuckovic, Hilke Bahmann
The Journal of Physical Chemistry Letters
|
November 10, 2020
Quantifying and Understanding Errors in Molecular Geometries
Stefan Vuckovic, Kieron Burke
The Journal of Chemical Physics
|
November 17, 2019
Range-separation and the multiple radii functional approximation inspired by the strongly interacting limit of density functional theory
Tim Gould, Stefan Vuckovic
Journal of Chemical Theory and Computation
|
June 16, 2025
"Slim" Benchmark Sets for Faster Method Development
Tim Gould, Stefan Vuckovic
The Journal of Physical Chemistry Letters
|
June 6, 2017
Simple Fully Nonlocal Density Functionals for Electronic Repulsion Energy
Stefan Vuckovic, Paola Gori-Giorgi
Physical Chemistry Chemical Physics : PCCP
|
April 10, 2024
Deep Mind 21 functional does not extrapolate to transition metal chemistry
Heng Zhao, Tim Gould, Stefan Vuckovic
Nature Communications
|
December 1, 2025
Real-space machine learning of correlation density functionals
Elias Polak, Heng Zhao, Stefan Vuckovic
Page
of 4
Search research articles
Search
Showing results (1-10 of 35) with videos related to
Sort By:
Page
of 4
The Journal of Physical Chemistry. A
|
February 11, 2022
Quantification of Geometric Errors Made Simple: Application to Main-Group Molecular Structures
Stefan Vuckovic
Journal of Chemical Theory and Computation
|
May 15, 2019
Density Functionals from the Multiple-Radii Approach: Analysis and Recovery of the Kinetic Correlation Energy
Stefan Vuckovic
Nature Computational Science
|
January 4, 2024
Using AI to navigate through the DFA zoo
Stefan Vuckovic
Journal of Chemical Theory and Computation
|
August 23, 2023
Nonlocal Functionals Inspired by the Strongly Interacting Limit of DFT: Exact Constraints and Implementation
Stefan Vuckovic, Hilke Bahmann
The Journal of Physical Chemistry Letters
|
November 10, 2020
Quantifying and Understanding Errors in Molecular Geometries
Stefan Vuckovic, Kieron Burke
The Journal of Chemical Physics
|
November 17, 2019
Range-separation and the multiple radii functional approximation inspired by the strongly interacting limit of density functional theory
Tim Gould, Stefan Vuckovic
Journal of Chemical Theory and Computation
|
June 16, 2025
"Slim" Benchmark Sets for Faster Method Development
Tim Gould, Stefan Vuckovic
The Journal of Physical Chemistry Letters
|
June 6, 2017
Simple Fully Nonlocal Density Functionals for Electronic Repulsion Energy
Stefan Vuckovic, Paola Gori-Giorgi
Physical Chemistry Chemical Physics : PCCP
|
April 10, 2024
Deep Mind 21 functional does not extrapolate to transition metal chemistry
Heng Zhao, Tim Gould, Stefan Vuckovic
Nature Communications
|
December 1, 2025
Real-space machine learning of correlation density functionals
Elias Polak, Heng Zhao, Stefan Vuckovic
Page
of 4