A density‐matrix divide‐and‐conquer approach for electronic structure calculations of large molecules
Author:
Publisher
AIP Publishing
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Link
http://aip.scitation.org/doi/pdf/10.1063/1.470549
Reference20 articles.
1. Self-Consistent Equations Including Exchange and Correlation Effects
2. Approximate density functional theory as a practical tool in molecular energetics and dynamics
3. Direct calculation of electron density in density-functional theory: Implementation for benzene and a tetrapeptide
4. Orbital formulation for electronic-structure calculations with linear system-size scaling
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