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The effect of curvature of Li-doped polycyclic hydrocarbon on its interaction energy with H2 and H2O: DF-SAPT (DFT) calculation
The effect of curvature of Li-doped polycyclic hydrocarbon on its interaction energy with H2 and H2O: DF-SAPT (DFT) calculation
The effect of curvature of Li-doped polycyclic hydrocarbon on its interaction energy with H2 and H2O: DF-SAPT (DFT) calculation
Dinuclear Nickel(II) and Copper(II) Complexes of 8-Quinoline-1 -H-pyrazole-3-carboxamide: Crystal Structure, Magnetic Properties, and DFT Calculations
Dinuclear Nickel(II) and Copper(II) Complexes of 8-Quinoline-1 -H-pyrazole-3-carboxamide: Crystal Structure, Magnetic Properties, and DFT Calculations
Dinuclear Nickel(II) and Copper(II) Complexes of 8-Quinoline-1 -H-pyrazole-3-carboxamide: Crystal Structure, Magnetic Properties, and DFT Calculations
G4MP2 DFT and CBS-Q calculation of proton and electron affinities gas phase basicities and ionization energies of hydroxylamines and alkanolamines
G4MP2 DFT and CBS-Q calculation of proton and electron affinities gas phase basicities and ionization energies of hydroxylamines and alkanolamines
Experimental and CIS TD-DFT ab initio calculations of visible spectra and the vibrational frequencies of sulfonyl azide-azoic dyes
Experimental and CIS TD-DFT ab initio calculations of visible spectra and the vibrational frequencies of sulfonyl azide-azoic dyes
A comparative DFT evaluation of the photocatalytic activity and NLO properties of monolayer two-dimensional M3X4 (M = C, Si, Ge; X = N, P, As) quantum dots
The Effect of Doping TiO2 Monolayer with Sn+4, Pb+4, and S-2 Ions on H2 Production by Photocatalytic Water Splitting: Periodic DFT Modeling
Vegetation mapping & studies” (A part of Comprehensive studies of Mouteh Wildlife Refuge)
تحصیلات
BNL-E-0913-914 (Brookhaven)