Articles by keywords "ab initio calculation"
Magnetic properties of low-dimensional MAX3 (M=Cr, A=Ge, Si and X=S, Se, Te) systems
- Year: 2022
- Volume: 49
- Issue: 1
- 64
- 1851
- Pages: 73-84
Ab initio calculations of electronic band structure of ideal and defective CdMnS
- Year: 2022
- Volume: 48
- Issue: 3
- 22
- 1647
- Pages: 419-427
Ab initio calculations of structural and thermal properties of wurtzite Zn1-xCdxO alloys with Debye-Gruneisen model
- Year: 2018
- Volume: 40
- Issue: 1
- 9
- 1838
- Pages: 112-116
Ab initio simulation of graphene interaction with SiO2 substrate for nanoelectronics application
- Year: 2018
- Volume: 39
- Issue: 1
- 30
- 2357
- Pages: 27-34