COMPUTATIONAL MATERIALS SCIENCE Journal

publication venue for

Spherical cluster method for ground state determination of site-disordered materials: Application to AgxBiyIx+3y. 231. 2024
Mechanical and electronic properties of transition metal hexa-nitrides in hexagonal structure from density functional theory calculations. 221. 2023
Electronic, optical, and thermoelectric properties of sodium pnictogen chalcogenides: A first principles study. 183. 2020
Computer-generated mesoporous materials and associated structural characterization. 157:156-167. 2019
Electronic and optical properties of vanadium oxides from first principles. 146:310-318. 2018
Transparency enhancement for SrVO3 by SrTiO3 mixing: A first-principles study. 144:139-146. 2018
LDA plus U/GGA plus U calculations of structural and electronic properties of CdTe: Dependence on the effective U parameter. 98:18-23. 2015
First-principles investigation of the structural, mechanical and electronic properties of the NbO-structured 3d, 4d and 5d transition metal nitrides. 84:365-373. 2014
Computation of radar absorbing silicon carbide foams and their silica matrix composites. 38:857-864. 2007

category

MATERIALS SCIENCE, MULTIDISCIPLINARY Category

International Standard Serial Number (ISSN)

0927-0256

Electronic International Standard Serial Number (EISSN)

1879-0801

journal abbreviation

COMP MATER SCI