Data · dataset · 2016
Direct Free Energy Calculation in the Continuous Fractional Component Gibbs Ensemble
Listed in DataCite
Description
Software illustrating the algorithms outlined in the following publication: Direct Free Energy Calculation in the Continuous Fractional Component Gibbs Ensemble A. Poursaeidesfahani, A. Torres-Knoop, D. Dubbeldam, T.J.H. Vlugt Journal of Chemical Theory and Computation, 2016, 12, 1481-1490. pubs.acs.org/doi/abs/10.1021/acs.jctc.5b01230
Links
Where it is published
- Repository landing page data.4tu.nl/articles/_/12680945/1 ↗
landing page · from DataCite
- DOI doi.org/10.4121/uuid:14e501bc-2408-41bc-90d5-5f4588604849 ↗
DOI / persistent id · from DataCite
Documentation and papers
- 4TU General Terms of Use doi.org/10.4121/resource:terms_of_use ↗
license · from DataCite
- References 10.1021/acs.jctc.5b01230 doi.org/10.1021/acs.jctc.5b01230 ↗
publication · from DataCite
Catalogue records · 2
- DataCite API api.datacite.org/dois/10.4121/uuid:14e501bc-2408-41bc-90d5-5f4588604849 ↗
metadata API · from DataCite
- DataCite Commons commons.datacite.org/doi.org/10.4121/uuid:14e501bc-2408-41bc-90d5-5f4588604849 ↗
catalogue entry · from DataCite
Topics
- Stated by source
- Chemical engineering · Chemical sciences
- From keywords
- Chemical engineering
Provenance · 1 source records, 7 field assertions
| Source | Key | Last seen | Raw |
|---|---|---|---|
| DataCite | 10.4121/uuid:14e501bc-2408-41bc-90d5-5f4588604849 | 14 d ago | JSON v1 |
| Field | Assertion | Extractor | Evidence |
|---|---|---|---|
| concepts[field].fos:chemical-engineering | source · DataCite | connector:datacite@1.0.0 | |
| concepts[field].fos:chemical-sciences | source · DataCite | connector:datacite@1.0.0 | |
| description | source · DataCite | connector:datacite@1.0.0 | /data/attributes/descriptions |
| license_text | source · DataCite | connector:datacite@1.0.0 | |
| publication_date | source · DataCite | connector:datacite@1.0.0 | /data/attributes/dates |
| title | source · DataCite | connector:datacite@1.0.0 | /data/attributes/titles/0/title |
| version_label | source · DataCite | connector:datacite@1.0.0 |