Performance of Density-Functional Tight-Binding in Comparison to Ab Initio and First-Principles Methods for Isomer Geometries and Energies of Glucose Epimers in Vacuo and Solution
- Department of Chemistry, Graduate School of Science, Nagoya University, Nagoya 464-8602, Japan, Bredesen Center for Interdisciplinary Research and Graduate Education, University of Tennessee, Knoxville, Tennessee 37996, United States
- Department of Chemistry and Biochemistry, Bradley University, Peoria, Illinois 61625, United States
- Department of Chemistry, Graduate School of Science, Nagoya University, Nagoya 464-8602, Japan
Not Available
- Sponsoring Organization:
- USDOE
- OSTI ID:
- 1484977
- Journal Information:
- ACS Omega, Journal Name: ACS Omega Journal Issue: 12 Vol. 3; ISSN 2470-1343
- Publisher:
- American Chemical SocietyCopyright Statement
- Country of Publication:
- United States
- Language:
- English
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