Repository details

Basis Set Exchange

Name of repository
Basis Set Exchange
Additional name(s)
  • EMSL Basis Set Exchange
  • BSE
Repository URL
https://www.basissetexchange.org/
Subject(s)
Description
The Basis Set Exchange (BSE) provides a web-based user interface for downloading and uploading Gaussian-type (GTO) basis sets, including effective core potentials (ECPs), from the EMSL Basis Set Library. It provides an improved user interface and capabilities over its predecessor, the EMSL Basis Set Order Form, for exploring the contents of the EMSL Basis Set Library. The popular Basis Set Order Form and underlying Basis Set Library were originally developed by Dr. David Feller and have been available from the EMSL webpages since 1994.
Contact(s)
  • se@molssi.org
Keyword(s)
Repository size
652 basis sets
Repository type(s)
  • disciplinary
Research data repository language(s)
  • English
Data and/or service provider
  • dataProvider

Institutions (2)

Institution
Pacific Northwest National Laboratory, Environmental Molecular Sciences Laboratory
Additional name(s)
  • EMSL
  • PNNL
Institution
Country
United States
Type(s) of responsibility
  • general
  • technical
Type of institution
non-profit
Institution
U.S. Department of Energy, Office of Science, Biological & Environmental Research
Additional name(s)
  • BER
Country
United States
Type(s) of responsibility
  • funding
Type of institution
non-profit

Policies (1)

Policy Name
About

Database access

Type of access to research data repository
open

Data access (1)

Type of access to data
open

Data licenses (1)

DataLicense
other

Data upload (1)

Type of data upload
restricted
Data upload restriction type(s)
  • registration
Persistent identifier system(s)
  • none
Name of the repository software
  • other
Versioning
yes
Data citation guideline
https://molssi-bse.github.io/basis_set_exchange-apidoc/
Enhanced Publication
no
Quality management
yes

Application programming interfaces (1)

Type
REST
Url
https://molssi-bse.github.io/basis_set_exchange-apidoc/

Remarks

Remarks
The popular Basis Set Order Form and underlying Basis Set Library were originally developed by Dr. David Feller and have been available from the EMSL webpages since 1994.
Entry date
2014-10-08
Last update
2022-12-19
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Cite this re3data.org record:

re3data.org: Basis Set Exchange; editing status 2022-12-19; re3data.org - Registry of Research Data Repositories. http://doi.org/10.17616/R3333W last accessed: 2025-04-30