The SIESTA method; developments and applicability
University of California, Berkeley · University of Cambridge · +8 more institutions
Indexed incrossrefpubmed
Abstract
Recent developments in and around the SIESTA method of first-principles simulation of condensed matter are described and reviewed, with emphasis on (i) the applicability of the method for large and varied systems, (ii) efficient basis sets for the standards of accuracy of density-functional methods, (iii) new implementations, and (iv) extensions beyond ground-state calculations.
Citation impact
824
total citations
- FWCI
- 20.13
- Percentile
- 100%
- References
- 62
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Authors
11Topics & keywords
Topics
Keywords
- SIESTA (computer program)
- Implementation
- Computer science
- Statistical physics
- Computational science
- Algorithm
- Chemistry
- Physics
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