Data collection: Benchmark Energy & Geometry Database

structure

General information

Recommended name Benchmark Energy & Geometry Database
Alternative name(s)
  • BEGDB
Description The Benchmark Energy & Geometry Database (BEGDB) collects results of highly accurate quantum mechanics (QM) calculations of molecular structures, energies and properties. These data can serve as benchmarks for testing and parameterization of other computational methods.
Identifier pattern^[0-9]+$
Registry identifierMIR:00000622

Identification schemes

Namespace begdb
URI http://identifiers.org/begdb/
Alternative URI schemes  

Physical locations (resources)

Resource
MIR:00100826
Description Benchmark Energy & Geometry Database
Access URLs HTML   (using the example identifier: 4214)
Institution Institute of Organic Chemistry and Biochemistry, Academy of Sciences of the Czech Republic, Prague, Czech Republic
Website http://www.begdb.com

References