Octahedral volumes
<p dir="ltr">This code computes the volume of the octahedron formed in six-coordinate chemical environments.</p>
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2025
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| _version_ | 1852022986833395712 |
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| author | Christopher Hendon (11321367) |
| author_facet | Christopher Hendon (11321367) |
| author_role | author |
| dc.creator.none.fl_str_mv | Christopher Hendon (11321367) |
| dc.date.none.fl_str_mv | 2025-02-05T19:52:53Z |
| dc.identifier.none.fl_str_mv | 10.6084/m9.figshare.28355312.v1 |
| dc.relation.none.fl_str_mv | https://figshare.com/articles/software/Octahedral_volumes/28355312 |
| dc.rights.none.fl_str_mv | CC BY 4.0 info:eu-repo/semantics/openAccess |
| dc.subject.none.fl_str_mv | Chemical thermodynamics and energetics atomic size atomic shape density functional theory |
| dc.title.none.fl_str_mv | Octahedral volumes |
| dc.type.none.fl_str_mv | Software info:eu-repo/semantics/publishedVersion software |
| description | <p dir="ltr">This code computes the volume of the octahedron formed in six-coordinate chemical environments.</p> |
| eu_rights_str_mv | openAccess |
| id | Manara_24eae9c856462540d3dda71c1480e7fb |
| identifier_str_mv | 10.6084/m9.figshare.28355312.v1 |
| network_acronym_str | Manara |
| network_name_str | ManaraRepo |
| oai_identifier_str | oai:figshare.com:article/28355312 |
| publishDate | 2025 |
| repository.mail.fl_str_mv | |
| repository.name.fl_str_mv | |
| repository_id_str | |
| rights_invalid_str_mv | CC BY 4.0 |
| spelling | Octahedral volumesChristopher Hendon (11321367)Chemical thermodynamics and energeticsatomic sizeatomic shapedensity functional theory<p dir="ltr">This code computes the volume of the octahedron formed in six-coordinate chemical environments.</p>2025-02-05T19:52:53ZSoftwareinfo:eu-repo/semantics/publishedVersionsoftware10.6084/m9.figshare.28355312.v1https://figshare.com/articles/software/Octahedral_volumes/28355312CC BY 4.0info:eu-repo/semantics/openAccessoai:figshare.com:article/283553122025-02-05T19:52:53Z |
| spellingShingle | Octahedral volumes Christopher Hendon (11321367) Chemical thermodynamics and energetics atomic size atomic shape density functional theory |
| status_str | publishedVersion |
| title | Octahedral volumes |
| title_full | Octahedral volumes |
| title_fullStr | Octahedral volumes |
| title_full_unstemmed | Octahedral volumes |
| title_short | Octahedral volumes |
| title_sort | Octahedral volumes |
| topic | Chemical thermodynamics and energetics atomic size atomic shape density functional theory |