Journal
COLLECTION OF CZECHOSLOVAK CHEMICAL COMMUNICATIONS
Volume 73, Issue 10, Pages 1261-1270Publisher
INST ORGANIC CHEM AND BIOCHEM
DOI: 10.1135/cccc20081261
Keywords
Ab initio calculations; CCSD(T); Coupled cluster method; Internet database; Molecular clusters
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Funding
- Institute of Organic Chemistry and Biochemistry [Z40550506]
- Academy of Sciences of the Czech Republic
- Ministry of Education, Youth and Sports of the Czech Republic [LC512, MSM 6198959216]
- Praemium Academiae
- Academy of Sciences of the Czech Republic,
Ask authors/readers for more resources
Our previous benchmark CCSD(T)/ complete basis set limit calculations were collected into a database named begdb - Benchmark Energy and Geometry DataBase. Web-based interface to this database was prepared and is available at www.begdb.com. Users can browse, search and plot the data online or download structures and energy tables.
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