Computational methods for large systems electronic structure approaches for biotechnology and nanotechnology /
"While its results normally complement the information obtained by chemical experiments, computer computations can in some cases predict unobserved chemical phenomena Electronic-Structure Computational Methods for Large Systems gives readers a simple description of modern electronic-structure t...
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| Format: | Electronic |
| Language: | English |
| Published: |
Hoboken, N.J. :
Wiley,
2011.
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| Subjects: | |
| Online Access: | https://recursos.uloyola.es/login?url=https://accedys.uloyola.es:8443/accedix0/sitios/ebook.php?id=179647 |
Table of Contents:
- A. DFT : the basic workhorse
- B. Higher-accuracy methods
- C. More-economical methods
- D. Advanced applications.