Variationally optimized atomic orbitals for large-scale electronic structures
Author:
Publisher
American Physical Society (APS)
Link
http://harvest.aps.org/v2/journals/articles/10.1103/PhysRevB.67.155108/fulltext
Reference19 articles.
1. Direct calculation of electron density in density-functional theory
2. Efficient Linear Scaling Algorithm for Tight-Binding Molecular Dynamics
3. Large scale electronic structure calculations
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