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DFT ab initio NMR and NBO analyses of Na-substituted hydrazino acetamides experimental VS theoretical values
Ab initio and DFT studies of hydrogen bond interactions in difluoroacetic acid dimer
Class-AB Square-Root Domain Filters Based on the Floating Gate MOS Translinear Principle
Ab initio and semiempirical conformational and configurational analysis of N-2-(1 4dioxane)-N -(4-methylbenzenesulfonyl)-O-(4-methylphenoxy)isourea
Ab initio and semiempirical conformational and configurational analysis of N-2-(1 4dioxane)-N -(4-methylbenzenesulfonyl)-O-(4-methylphenoxy)isourea
DFT and ab initio potential energy scan and hydrogen bond analysis of Na-substituted hydrazino acetamides characterization of the hydrazinoturn hydrogen bonding pattern
DFT Ab initio and FT-IR studies of the structure of sulfonamide Triazenes
DFT Ab initio and FT-IR studies of the structure of sulfonamide Triazenes
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
DFT and ab initio study of structure of dyes derived from 2-hydroxy and 2 4-dihydroxy benzoic acids
DFT and ab initio study of structure of dyes derived from 2-hydroxy and 2 4-dihydroxy benzoic acids
DFT and ab initio calculations of the vibrational frequencies and visible spectra of triazenes derived from cyclic amines
DFT and ab initio calculations of the vibrational frequencies and visible spectra of triazenes derived from cyclic amines
Ab-initio study of structural and electronic properties of III-arsenide binary compounds