ab initio simulations with ORCA
ab initio and density functional theory calculations in molecules
Main Author: | |
---|---|
Format: | Article in Journal/Newspaper |
Language: | English |
Published: |
nanoHUB
2015
|
Subjects: | |
Online Access: | https://dx.doi.org/10.4231/d3m03xz31 https://nanohub.org/resources/22577?rev=20 |
id |
ftdatacite:10.4231/d3m03xz31 |
---|---|
record_format |
openpolar |
spelling |
ftdatacite:10.4231/d3m03xz31 2023-05-15T17:53:08+02:00 ab initio simulations with ORCA Onofrio, Nicolas 2015 https://dx.doi.org/10.4231/d3m03xz31 https://nanohub.org/resources/22577?rev=20 en eng nanoHUB Software Simulation Tool article SoftwareSourceCode 2015 ftdatacite https://doi.org/10.4231/d3m03xz31 2021-11-05T12:55:41Z ab initio and density functional theory calculations in molecules 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 in molecules |
format |
Article in Journal/Newspaper |
author |
Onofrio, Nicolas |
spellingShingle |
Onofrio, Nicolas ab initio simulations with ORCA |
author_facet |
Onofrio, Nicolas |
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 |
2015 |
url |
https://dx.doi.org/10.4231/d3m03xz31 https://nanohub.org/resources/22577?rev=20 |
genre |
Orca |
genre_facet |
Orca |
op_doi |
https://doi.org/10.4231/d3m03xz31 |
_version_ |
1766160852899069952 |