Recent progress in linear-scaling density functional calculations with plane waves and pseudopotentials: the ONETEP code
Author:
Publisher
IOP Publishing
Subject
Condensed Matter Physics,General Materials Science
Link
http://stacks.iop.org/0953-8984/20/i=6/a=064209/pdf
Reference46 articles.
1. Inhomogeneous Electron Gas
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1. Corrigendum: Recent progress in linear-scaling density functional calculations with plane waves and pseudopotentials: the ONETEP code (2008 J. Phys.: Condens. Matter 20 064209);Journal of Physics: Condensed Matter;2020-05-18
2. A General Algorithm to Calculate the Inverse Principal p-th Root of Symmetric Positive Definite Matrices;Communications in Computational Physics;2019
3. Structural properties of silicon–germanium and germanium–silicon core–shell nanowires;Journal of Physics: Condensed Matter;2018-10-30
4. Linear scaling DFT calculations for large tungsten systems using an optimized local basis;Nuclear Materials and Energy;2018-05
5. Efficient Computation of Sparse Matrix Functions for Large-Scale Electronic Structure Calculations: The CheSS Library;Journal of Chemical Theory and Computation;2017-09-27
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