Calculating Interaction Energies Using First Principle Theories: Consideration of Basis Set Superposition Error and Fragment Relaxation
| Document Type: | Article |
|---|---|
| Language: | English |
| Author: | Karl N. Kirschner, Jennifer B. Sorensen, J. Phillip Bowen |
| Parent Title (English): | Journal of Chemical Education |
| Volume: | 84 |
| Issue: | 7 |
| First Page: | 1225 |
| Last Page: | 1229 |
| ISSN: | 0021-9584 |
| DOI: | https://doi.org/10.1021/ed084p1225 |
| Publisher: | American Chemical Society |
| Place of publication: | Washington, DC |
| Date of first publication: | 2007/07/01 |
| Dewey Decimal Classification (DDC): | 5 Naturwissenschaften und Mathematik / 54 Chemie / 540 Chemie und zugeordnete Wissenschaften |
| Entry in this database: | 2021/05/18 |
