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The Effect of d10 Precious Elements on Structural, Magnetic and Elastic Properties of MnPt Alloy: A First-Principles StudyMATERIALSIF3.22024-01-231OAAI
Self-consistent charge density functional tight-binding (SCC-DFTB) parameterization and validation for Ti50Pd50-XRuX alloysCOMPUTATIONAL MATERIALS SCIENCEIF3.32023-02-012PRE
Compositional Dependence of Magnetocrystalline Anisotropy, Magnetic Moments, and Energetic and Electronic Properties on Fe-Pt AlloysMATERIALSIF3.22022-08-183OAAI
First-principles study: Effect of lithium and sodium intercalation in transition metal phosphates, MPO4 (M: Mn, Fe, Co)COMPUTATIONAL CONDENSED MATTERIF3.92020-03-0118PREAI
Thermodynamic stability and pressure dependence of FePO4 polymorphsCOMPUTATIONAL AND THEORETICAL CHEMISTRYIF2.82019-05-0113PREAI
Structural, elastic and electronic properties of equiatomic PtTi as potential high-temperature shape memory alloyINTERMETALLICSIF4.82013-02-0126PREAI
Link between structural and mechanical stability of fcc- and bcc-based ordered Mg-Li alloysINTERMETALLICSIF4.82010-11-0169PREAI
Electronic Structure and Redox Properties of the Ti-Doped Zirconia (111) SurfaceJOURNAL OF PHYSICAL CHEMISTRY CIF3.22010-08-2421PREAI
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