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

Preview Full PDF

Authors

Keywords:

Density functional theory tight‐bind method DFT TDDFT DFTB TD‐DFTB GPU.
About this article

Abstract View

Pdf View

DOI

10.4208/cicc.2013.v1.n2.3

How to Cite

Efficient Implementation of Time-Dependent Density Functional-Based Tight-Bind Method on Multi-Core and GPU System. (2013). Communications in Computational Chemistry, 1(2), 124-131. https://doi.org/10.4208/cicc.2013.v1.n2.3