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7 forks: 7 public, 0 internal, and 0 private
Created date
View Dalton Project project
Einar Aurbakken /
Dalton Project
added verbose argument
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Updated
May 26, 2022
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May 26, 2022
View Dalton Project project
Xinide W /
Dalton Project
Use basis in work directory if it exists
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Updated
Sep 17, 2020
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Sep 17, 2020
View Dalton Project project
dakkki /
Dalton Project
Use basis in work directory if it exists
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Updated
Sep 13, 2020
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Sep 13, 2020
View Dalton Project project
antonio arapiraca /
Dalton Project
Extract molecular gradients from LSDalton output
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Updated
Jul 29, 2020
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Jul 29, 2020
View DaltonProject project
Roberto Di Remigio /
DaltonProject
Fix bug when writing a molecule with symmetry
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Updated
Jan 30, 2020
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Jan 30, 2020
View DaltonProject project
Olav Vahtras /
DaltonProject
High spin open-shell SCF
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Updated
Sep 06, 2024
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Sep 06, 2024
View DaltonProject project
Peter Reinholdt /
DaltonProject
Adds geometry optimization through LSDalton
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Updated
Nov 04, 2019
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Nov 04, 2019
