Reproducible Code for Fitting Ancillary curves for the PC-SAFT equation of state
This dataset includes the code needed to reproduce all the results from "Superancillary equations for PC-SAFT" by Ian Bell (NIST) and Ulrich Deiters (Cologne).It includes C++ code for the development of the formulation, and the scripts and other files needed to build the python package and build all the plots from the publicationSee the README.md file for more detailed information of the contents
Resources
3 resources available
-
Working code for PCSAFTsuperanc
FILE -
Zip file containing C++ and Python Scripts
ZIP FOLDER -
Zip of the scripts and data files
APPLICATION/ZIP
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Complete Metadata
| @type | dcat:Dataset |
|---|---|
| accessLevel | public |
| bureauCode |
[
"006:55"
]
|
| contactPoint |
{
"fn": "Ian Bell",
"hasEmail": "mailto:ian.bell@nist.gov"
}
|
| description | This dataset includes the code needed to reproduce all the results from "Superancillary equations for PC-SAFT" by Ian Bell (NIST) and Ulrich Deiters (Cologne).It includes C++ code for the development of the formulation, and the scripts and other files needed to build the python package and build all the plots from the publicationSee the README.md file for more detailed information of the contents |
| distribution |
[
{
"title": "Working code for PCSAFTsuperanc",
"accessURL": "https://github.com/usnistgov/SAFTsuperanc",
"description": "The working repository from which this record is snapshotted"
},
{
"title": "Zip file containing C++ and Python Scripts",
"format": "Zip Folder",
"mediaType": "application/gzip",
"description": "Zip file containing C++ and Python Scripts",
"downloadURL": "https://data.nist.gov/od/ds/mds2-2713/MIDAS.zip"
},
{
"title": "Zip of the scripts and data files",
"mediaType": "application/zip",
"downloadURL": "https://data.nist.gov/od/ds/mds2-2713/MIDAS.zip"
}
]
|
| identifier | ark:/88434/mds2-2713 |
| issued | 2022-07-26 |
| keyword |
[
"Chebyshev expansion",
"algorithms",
"arbitrary precision",
"equation of state",
"superancillary"
]
|
| landingPage | https://data.nist.gov/od/id/mds2-2713 |
| language |
[
"en"
]
|
| license | https://www.nist.gov/open/license |
| modified | 2022-07-14 00:00:00 |
| programCode |
[
"006:045"
]
|
| publisher |
{
"name": "National Institute of Standards and Technology",
"@type": "org:Organization"
}
|
| references |
[
"https://doi.org/10.1021/acs.iecr.2c02916"
]
|
| theme |
[
"Mathematics and Statistics:Numerical methods and software"
]
|
| title | Reproducible Code for Fitting Ancillary curves for the PC-SAFT equation of state |
