Efficient Implementation of Time-Dependent Density Functional-Based Tight-Bind Method on Multi-Core and GPU System

Efficient Implementation of Time-Dependent Density Functional-Based Tight-Bind Method on Multi-Core and GPU System

Year:    2013

Communications in Computational Chemistry, Vol. 1 (2013), Iss. 2 : pp. 124–131

Abstract

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Journal Article Details

Publisher Name:    Global Science Press

Language:    English

DOI:    https://doi.org/10.4208/cicc.2013.v1.n2.3

Communications in Computational Chemistry, Vol. 1 (2013), Iss. 2 : pp. 124–131

Published online:    2013-01

AMS Subject Headings:    Global Science Press

Copyright:    COPYRIGHT: © Global Science Press

Pages:    8

Keywords:    Density functional theory tight‐bind method DFT TDDFT DFTB TD‐DFTB GPU.

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