Introducing k-point parallelism into VASP-Reference-Cited by-同舟云学术

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Introducing k-point parallelism into VASP

Published:2012-08 Issue:8 Volume:183 Page:1696-1701
ISSN:0010-4655
Container-title:Computer Physics Communications
language:en
Short-container-title:Computer Physics Communications

Author:

Maniopoulou Asimina,Davidson Erlend R.M.,Grau-Crespo Ricardo,Walsh Aron,Bush Ian J.,Catlow C. Richard A.,Woodley Scott M.

Funder

EPSRC

Office of Science and Technology

Publisher

Elsevier BV

Subject

General Physics and Astronomy,Hardware and Architecture

Reference52 articles.

1. Unified Approach for Molecular Dynamics and Density-Functional Theory

2. Inhomogeneous Electron Gas

3. Self-Consistent Equations Including Exchange and Correlation Effects

4. Energy-Band Interpolation Scheme Based on a Pseudopotential

5. The Fitting of Pseudopotentials to Experimental Data and Their Subsequent Application

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