12 results on '"gga"'
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2. Tuning the optical properties through bandgap engineering in Si-doped YAuPb: ab initio study
3. Structural and Electronic Calculations of CdTe Using DFT: Exchange–Correlation Functionals and DFT-1/2 Corrections
4. Elastic, Half-Metallicity, Thermodynamic, and Transport Properties of Ru2VGe and Ru2VSb Full-Heusler Compounds: a First-Principle Study
5. A Density Functional Study on the Sensitivity of Small ZnO Nanoclusters to Sulfamethazine Considering Semilocal and Nonlocal Functionals
6. Magneto-electronic and Thermodynamic Properties of Quaternary NiFeMnZ (Z = In, Sn) New Spin Gapless Semiconductors
7. Theoretical Prediction of Structural, Electronic, and Magnetic Properties of Rh2YIn (Y = Nd, Sm) Full-Heusler Alloys
8. Electronic and Magnetic Properties of Ru2FeSi1−xGex Alloys in B2 Structure: a First-Principle Study
9. Improving the performance of water distribution systems’ simulation on multicore systems
10. Analysis of tunneling currents in multilayer black phosphorous and MoS 2 non-volatile flash memory cells
11. Theoretical investigation of spontaneous polarization, electronic and optical properties of cubic perovskite BaHfO3
12. A First Principle Study of Co2CrZ (Z=In, Sn, Sb) Based on FP-LAPW Method
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