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Proynov, Emil
49  Ergebnisse:
Personensuche X
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1

Analyzing cases of significant nondynamic correlation with ..:

Lewis, Conrad ; Proynov, Emil ; Yu, Jianguo.
Theoretical Chemistry Accounts.  141 (2022)  3 - p. , 2022
Link: https://doi.org/10.1007/..
 
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2

Correcting the Charge Delocalization Error of Density Funct..:

Proynov, Emil ; Kong, Jing
Journal of Chemical Theory and Computation.  17 (2021)  8 - p. 4633-4638 , 2021
Link: https://doi.org/10.1021/..
 
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3

Model DFT exchange holes and the exact exchange hole: Simil..:

Wang, Yiting ; Proynov, Emil ; Kong, Jing
The Journal of Chemical Physics.  154 (2021)  2 - p. , 2021
Link: https://doi.org/10.1063/..
 
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4

Reducing charge delocalization error of density functional ..:

Proynov, Emil ; Kong, Jing
http://arxiv.org/abs/2102.12992.  , 2021
Link: http://arxiv.org/abs/210..
 
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5

Correcting the Charge Delocalization Error of Density Funct..:

Emil Proynov (1441654) ; Jing Kong (531041)
https://figshare.com/articles/journal_contribution/Correcting_the_Charge_Delocalization_Error_of_Density_Functional_Theory/15046767.  , 2021
Link: https://doi.org/10.1021/..
 
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6

Software for the frontiers of quantum chemistry: An overvie..:

Epifanovsky, Evgeny ; Gilbert, Andrew T. B ; Feng, Xintian...
https://doi.org/10.1063/5.0055522.  , 2021
Link: https://doi.org/10.1063/..
 
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7

Software for the frontiers of quantum chemistry: An overvie..:

Epifanovsky, Evgeny ; Gilbert, Andrew T. B ; Feng, Xintian...
https://nottingham-repository.worktribe.com/output/6395203.  , 2021
Link: https://doi.org/10.1063/..
 
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8

Analyzing cases of significant nondynamic correlation with ..:

Lewis, Conrad ; Proynov, Emil ; Yu, Jianguo.
http://arxiv.org/abs/2109.04371.  , 2021
Link: http://arxiv.org/abs/210..
 
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9

Software for the frontiers of quantum chemistry:An overview..:

Epifanovsky, Evgeny ; Gilbert, Andrew T B ; Feng, Xintian...
https://research.rug.nl/en/publications/e8660781-79b4-4f4e-92e0-2dd90c54183b.  , 2021
Link: https://hdl.handle.net/1..
 
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10

Software for the frontiers of quantum chemistry: An overvie..:

Epifanovsky, Evgeny ; Gilbert, Andrew T. B ; Feng, Xintian...
https://orbit.dtu.dk/en/publications/26ccfa56-a14c-4ef4-98ea-6de5a1483f6b.  , 2021
Link: https://orbit.dtu.dk/en/..
 
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11

Correcting the Charge Delocalization Error of Density Funct..:

Emil Proynov (1441654) ; Jing Kong (531041)
https://figshare.com/articles/dataset/Correcting_the_Charge_Delocalization_Error_of_Density_Functional_Theory/15046770.  , 2021
Link: https://doi.org/10.1021/..
 
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12

Software for the frontiers of quantum chemistry: An overvie..:

Epifanovsky, Evgeny ; Gilbert, Andrew T. B ; Feng, Xintian...
https://zenodo.org/record/5484917.  , 2021
Link: https://zenodo.org/recor..
 
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13

Performance of new density functionals of nondynamic correl..:

Wang, Matthew ; John, Dwayne ; Yu, Jianguo...
The Journal of Chemical Physics.  150 (2019)  20 - p. , 2019
Link: https://doi.org/10.1063/..
 
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14

Long-range-corrected Rung 3.5 density functional approximat..:

Janesko, Benjamin G. ; Proynov, Emil ; Scalmani, Giovanni.
The Journal of Chemical Physics.  148 (2018)  10 - p. , 2018
Link: https://doi.org/10.1063/..
 
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15

Testing Exact Upper Bounds to Exact Exchange:

Proynov, Emil ; Janesko, Benjamin G.
Journal of Chemical Theory and Computation.  13 (2017)  5 - p. 1980-1988 , 2017
Link: https://doi.org/10.1021/..
 
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