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Results: 1-11 |
Results: 11
INFRARED VIBRATIONAL INTENSITIES, POLAR TENSORS, AND CORE ELECTRON ENERGIES OF THE GROUP-IV HYDRIDES AND THE FLUOROSILANES
Authors: DEOLIVEIRA AE GUADAGNINI PH CUSTODIO R BRUNS RE
Citation: Ae. Deoliveira et al., INFRARED VIBRATIONAL INTENSITIES, POLAR TENSORS, AND CORE ELECTRON ENERGIES OF THE GROUP-IV HYDRIDES AND THE FLUOROSILANES, The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 102(24), 1998, pp. 4615-4622
POLYCARBONITRILE - A SEMIEMPIRICAL, AB-INITIO AND DENSITY-FUNCTIONAL STUDY OF MOLECULAR-STABILITY
Authors: DELNERO J LAKS B CUSTODIO R
Citation: J. Delnero et al., POLYCARBONITRILE - A SEMIEMPIRICAL, AB-INITIO AND DENSITY-FUNCTIONAL STUDY OF MOLECULAR-STABILITY, Synthetic metals, 85(1-3), 1997, pp. 1127-1128
BASIS-SET MODELING FOR MOLECULAR CALCULATIONS USING EFFECTIVE CORE POTENTIAL
Authors: GIORDAN M CUSTODIO R
Citation: M. Giordan et R. Custodio, BASIS-SET MODELING FOR MOLECULAR CALCULATIONS USING EFFECTIVE CORE POTENTIAL, Journal of computational chemistry, 18(15), 1997, pp. 1918-1929
A METHOD FOR THE DETERMINATION OF THE HARTREE-FOCK LIMIT - APPLICATION TO CLOSED-SHELL ATOMS
Authors: MORGON NH CUSTODIO R MOHALLEM JR
Citation: Nh. Morgon et al., A METHOD FOR THE DETERMINATION OF THE HARTREE-FOCK LIMIT - APPLICATION TO CLOSED-SHELL ATOMS, Journal of molecular structure. Theochem, 394(2-3), 1997, pp. 95-100
A UNIVERSAL BASIS-SET TO BE USED ALONG WITH PSEUDOPOTENTIALS
Authors: GIORDAN M CUSTODIO R MORGON NH
Citation: M. Giordan et al., A UNIVERSAL BASIS-SET TO BE USED ALONG WITH PSEUDOPOTENTIALS, Chemical physics letters, 279(5-6), 1997, pp. 396-402
PYRROLIZIDINE ALKALOIDS NECINE BASES - AB-INITIO, SEMIEMPIRICAL, AND MOLECULAR MECHANICS APPROACHES TO MOLECULAR-PROPERTIES
Authors: GIORDAN M CUSTODIO R TRIGO JR
Citation: M. Giordan et al., PYRROLIZIDINE ALKALOIDS NECINE BASES - AB-INITIO, SEMIEMPIRICAL, AND MOLECULAR MECHANICS APPROACHES TO MOLECULAR-PROPERTIES, Journal of computational chemistry, 17(2), 1996, pp. 156-166
INFLUENCE OF POLARIZATION FUNCTIONS ON ATOMIC PROPERTIES OF BRIDGE N-ATOM AND H-ATOM OF HCN-CENTER-DOT-CENTER-DOT-CENTER-DOT-HCN
Authors: MORGON NH CUSTODIO R TOSTES JGR TAFT CA
Citation: Nh. Morgon et al., INFLUENCE OF POLARIZATION FUNCTIONS ON ATOMIC PROPERTIES OF BRIDGE N-ATOM AND H-ATOM OF HCN-CENTER-DOT-CENTER-DOT-CENTER-DOT-HCN, Journal of molecular structure. Theochem, 335, 1995, pp. 11-23
A THEORETICAL-STUDY OF ISOMERIC C6H4BR- IONS
Authors: MORGON NH CUSTODIO R RIVEROS JM
Citation: Nh. Morgon et al., A THEORETICAL-STUDY OF ISOMERIC C6H4BR- IONS, Chemical physics letters, 235(5-6), 1995, pp. 436-443
VALENCE BASIS-SETS FOR TELLURIUM - WEIGHT-FUNCTIONS AS A BASIS-SET DEVELOPMENT TOOL AND INITIAL MOLECULAR APPLICATIONS
Authors: CUSTODIO R DAVIS WM GODDARD JD
Citation: R. Custodio et al., VALENCE BASIS-SETS FOR TELLURIUM - WEIGHT-FUNCTIONS AS A BASIS-SET DEVELOPMENT TOOL AND INITIAL MOLECULAR APPLICATIONS, Journal of molecular structure. Theochem, 121, 1994, pp. 163-172
CAN THE LINEAR COMBINATION OF ATOMIC ORBITAL COEFFICIENTS (THE WEIGHTFUNCTION) BE USED TO IMPROVE THE WAVE-FUNCTION
Authors: CUSTODIO R GODDARD JD
Citation: R. Custodio et Jd. Goddard, CAN THE LINEAR COMBINATION OF ATOMIC ORBITAL COEFFICIENTS (THE WEIGHTFUNCTION) BE USED TO IMPROVE THE WAVE-FUNCTION, Journal of molecular structure. Theochem, 100(1), 1993, pp. 75-87
DEVELOPMENT OF PHONOLOGICAL AND ORTHOGRAPHIC SKILL - A 2-YEAR LONGITUDINAL-STUDY OF DYSLEXIC-CHILDREN
Authors: MANIS FR CUSTODIO R SZESZULSKI PA
Citation: Fr. Manis et al., DEVELOPMENT OF PHONOLOGICAL AND ORTHOGRAPHIC SKILL - A 2-YEAR LONGITUDINAL-STUDY OF DYSLEXIC-CHILDREN, Journal of experimental child psychology, 56(1), 1993, pp. 64-86
Risultati: 1-11 |