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Can I read Quantum Chemical Benchmark Energy and Geometry Database for Molecular Clusters and Complex Molecular Systems on EtoBox?
Quantum Chemical Benchmark Energy and Geometry Database for Molecular Clusters and Complex Molecular Systems by Řezáč, Jan; Jurečka, Petr; Riley, Kevin E.; Černý, Jiří; Valdes, Haydee; Pluháčková, Kristýna; Berka, Karel; Řezáč, Tomáš; Pitoňák, Michal; Vondrášek, Jiří; Hobza, Pavel is a Chemistry article available to read on EtoBox.
What is Quantum Chemical Benchmark Energy and Geometry Database for Molecular Clusters and Complex Molecular Systems about?
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.
Who reads Quantum Chemical Benchmark Energy and Geometry Database for Molecular Clusters and Complex Molecular Systems?
It is typically read by researchers, students, and practitioners in Chemistry.
- Author
- Řezáč, Jan; Jurečka, Petr; Riley, Kevin E.; Černý, Jiří; Valdes, Haydee; Pluháčková, Kristýna; Berka, Karel; Řezáč, Tomáš; Pitoňák, Michal; Vondrášek, Jiří; Hobza, Pavel
- Publisher
- UOCHB; Institute of Organic Chemistry & Biochemistry, Academy of Sciences of the Czech Republic; Akademie Ved Ceske Republiky; Institute of Organic Chemistry & Biochemistry (ISSN 0010-0765)
- Published
- 2008
- Language
- EN
- Field
- Chemistry (Physical Sciences)