ab initio simulations with ORCA
ab initio and density functional theory calculations dedicated to molecular systems
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Format: | Article in Journal/Newspaper |
Language: | English |
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Online Access: | https://dx.doi.org/10.4231/d3zs2kf1v https://nanohub.org/resources/22577?rev=28 |
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ftdatacite:10.4231/d3zs2kf1v 2023-05-15T17:53:09+02:00 ab initio simulations with ORCA Onofrio, Nicolas Strachan, Alejandro 2016 https://dx.doi.org/10.4231/d3zs2kf1v https://nanohub.org/resources/22577?rev=28 en eng nanoHUB Software Simulation Tool article SoftwareSourceCode 2016 ftdatacite https://doi.org/10.4231/d3zs2kf1v 2021-11-05T12:55:41Z ab initio and density functional theory calculations dedicated to molecular systems Article in Journal/Newspaper Orca DataCite Metadata Store (German National Library of Science and Technology) |
institution |
Open Polar |
collection |
DataCite Metadata Store (German National Library of Science and Technology) |
op_collection_id |
ftdatacite |
language |
English |
description |
ab initio and density functional theory calculations dedicated to molecular systems |
format |
Article in Journal/Newspaper |
author |
Onofrio, Nicolas Strachan, Alejandro |
spellingShingle |
Onofrio, Nicolas Strachan, Alejandro ab initio simulations with ORCA |
author_facet |
Onofrio, Nicolas Strachan, Alejandro |
author_sort |
Onofrio, Nicolas |
title |
ab initio simulations with ORCA |
title_short |
ab initio simulations with ORCA |
title_full |
ab initio simulations with ORCA |
title_fullStr |
ab initio simulations with ORCA |
title_full_unstemmed |
ab initio simulations with ORCA |
title_sort |
ab initio simulations with orca |
publisher |
nanoHUB |
publishDate |
2016 |
url |
https://dx.doi.org/10.4231/d3zs2kf1v https://nanohub.org/resources/22577?rev=28 |
genre |
Orca |
genre_facet |
Orca |
op_doi |
https://doi.org/10.4231/d3zs2kf1v |
_version_ |
1766160876601081856 |