cyllab/ccinput: v1.5.1
Commits 669f0f3: Updated the documentation (Raphaël Robidas) bcdd713: Minor improvements to basis set data (Raphaël Robidas) 2c38703: Added option to parse charge and multiplicity from file names (Raphaël Robidas) 8049ecb: Added explicit memory specification in ORCA input files (Raphaël Robidas) f2d...
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2022
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Online Access: | https://zenodo.org/record/7032210 https://doi.org/10.5281/zenodo.7032210 |
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openpolar |
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ftzenodo:oai:zenodo.org:7032210 2023-11-05T03:44:31+01:00 cyllab/ccinput: v1.5.1 Raphaël Robidas Lint Action 2022-08-29 https://zenodo.org/record/7032210 https://doi.org/10.5281/zenodo.7032210 unknown https://github.com/cyllab/ccinput/tree/v1.5.1 doi:10.5281/zenodo.5907043 https://zenodo.org/record/7032210 https://doi.org/10.5281/zenodo.7032210 oai:zenodo.org:7032210 info:eu-repo/semantics/openAccess info:eu-repo/semantics/other software 2022 ftzenodo https://doi.org/10.5281/zenodo.703221010.5281/zenodo.5907043 2023-10-10T22:58:39Z Commits 669f0f3: Updated the documentation (Raphaël Robidas) bcdd713: Minor improvements to basis set data (Raphaël Robidas) 2c38703: Added option to parse charge and multiplicity from file names (Raphaël Robidas) 8049ecb: Added explicit memory specification in ORCA input files (Raphaël Robidas) f2d1669: Corrected name handling (Raphaël Robidas) Software Orca Zenodo |
institution |
Open Polar |
collection |
Zenodo |
op_collection_id |
ftzenodo |
language |
unknown |
description |
Commits 669f0f3: Updated the documentation (Raphaël Robidas) bcdd713: Minor improvements to basis set data (Raphaël Robidas) 2c38703: Added option to parse charge and multiplicity from file names (Raphaël Robidas) 8049ecb: Added explicit memory specification in ORCA input files (Raphaël Robidas) f2d1669: Corrected name handling (Raphaël Robidas) |
format |
Software |
author |
Raphaël Robidas Lint Action |
spellingShingle |
Raphaël Robidas Lint Action cyllab/ccinput: v1.5.1 |
author_facet |
Raphaël Robidas Lint Action |
author_sort |
Raphaël Robidas |
title |
cyllab/ccinput: v1.5.1 |
title_short |
cyllab/ccinput: v1.5.1 |
title_full |
cyllab/ccinput: v1.5.1 |
title_fullStr |
cyllab/ccinput: v1.5.1 |
title_full_unstemmed |
cyllab/ccinput: v1.5.1 |
title_sort |
cyllab/ccinput: v1.5.1 |
publishDate |
2022 |
url |
https://zenodo.org/record/7032210 https://doi.org/10.5281/zenodo.7032210 |
genre |
Orca |
genre_facet |
Orca |
op_relation |
https://github.com/cyllab/ccinput/tree/v1.5.1 doi:10.5281/zenodo.5907043 https://zenodo.org/record/7032210 https://doi.org/10.5281/zenodo.7032210 oai:zenodo.org:7032210 |
op_rights |
info:eu-repo/semantics/openAccess |
op_doi |
https://doi.org/10.5281/zenodo.703221010.5281/zenodo.5907043 |
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1781704587936268288 |