CHEMISORPTION THEORY FOR METALLIC SURFACES: CONVERGENCE OF SURFACE LOCALIZED ORBITALS FOR TI(0001) CLUSTERS = THEORIE DE LA CHIMISORPTION DE SURFACES METALLIQUES: CONVERGENCE DES ORBITALES LOCALISEES DE SURFACE POUR DES AMAS TI(0001)WHITTEN JL.1981; PHYS. REV. B; ISSN 0163-1829; USA; DA. 1981; VOL. 24; NO 4; PP. 1810-1817; BIBL. 25 REF.Article

ELECTRONIC STRUCTURE OF TIH AND TI CHAINS USING THE XALPHA -SW METHODFISCHER CR; WHITTEN JL.1979; PHYS. REV., B; USA; DA. 1979; VOL. 20; NO 4; PP. 1353-1361; BIBL. 15 REF.Article

ITERATIVE NATURAL ORBITALS FOR CONFIGURATION INTERACTION USING PERTURBATION THEORY.JAFRI JA; WHITTEN JL.1977; THEOR. CHIM. ACTA; ALLEM.; DA. 1977; VOL. 44; NO 3; PP. 305-313; BIBL. 17 REF.Article

LOCALIZED ORBITAL SCF AND CI STUDIES OF GROUND ELECTRONIC STATESWILHITE DL; WHITTEN JL.1973; J. CHEM. PHYS.; U.S.A.; DA. 1973; VOL. 58; NO 3; PP. 948-955; BIBL. 24 REF.Serial Issue

HYDROGEN ADSORPTION ON COPPER: EMBEDDING THEORY BASED ON ORBITAL LOCALIZATIONMADHAVAN PV; WHITTEN JL.1981; SURF. SCI.; ISSN 0039-6028; NLD; DA. 1981; VOL. 112; NO 1-2; PP. 38-51; BIBL. DISSEM.Article

HYDROGEN ADSORPTION ON COPPER: EMBEDDING THEORY BASED ON ORBITAL LOCALIZATIONMADHAVAN PV; WHITTEN JL.1981; SURF. SCI.; NLD; DA. 1981-12; VOL. 112; NO 1/2; PP. 38-51; BIBL. 12 REF.Article

INTERMEDIATE MOLECULAR SPECIES IN THE OXIDATION OF H₂S. AN AB INITIO CONFIGURATION INTERACTION STUDYBESNAINOU S; WHITTEN JL.1980; J. AM. CHEM. SOC.; ISSN 0002-7863; USA; DA. 1980; VOL. 102; NO 25; PP. 7444-7448; BIBL. 30 REF.Article

THEORETICAL STUDIES OF THE CHEMISORPTION OF HYDROGEN ON COPPER = ETUDES THEORIQUES DE LA CHIMISORPTION DE L'HYDROGENE SUR DU CUIVREMADHAVAN P; WHITTEN JL.1982; J. CHEM. PHYS.; ISSN 0021-9606; USA; DA. 1982; VOL. 77; NO 5; PP. 2673-2683; BIBL. 31 REF.Article

CHEMISORPTION OF HYDROGEN ON TITANIUM: EMBEDDING THEORY AND COMPARISONS WITH SMALL CLUSTERSCREMASCHI P; WHITTEN JL.1981; SURF. SCI.; NLD; DA. 1981-12; VOL. 112; NO 3; PP. 343-358; BIBL. 23 REF.Article

ELECTRON DENSITY AND DENSITY MATRIX APPROXIMATIONS USING POTENTIAL ENERGY ERROR BOUNDSPAKKANEN TA; WHITTEN JL.1978; J. CHEM. PHYS.; USA; DA. 1978; VOL. 69; NO 5; PP. 2168-2174; BIBL. 6 REF.Article

THEORETICAL STUDIES OF THE PROTONATION OF CYCLOBUTANE.PAKKANEN T WHITTEN JL.1975; J. AMER. CHEM. SOC.; U.S.A.; DA. 1975; VOL. 97; NO 22; PP. 6337-6340; BIBL. 16 REF.Article

ELECTRON REPULSION INTEGRAL APPROXIMATIONS AND ERROR BOUNDS: MOLECULAR APPLICATIONS.JAFRI JA; WHITTEN JL.1974; J. CHEM. PHYS.; U.S.A.; DA. 1974; VOL. 61; NO 5; PP. 2116-2121; BIBL. 4 REF.Article

CHEMISORPTION THEORY FOR METALLIC SURFACES: ELECTRON LOCALIZATION AND THE DESCRIPTION OF SURFACE INTERACTIONS = THEORIE DE LA CHIMISORPTION POUR LES SURFACES METALLIQUES: LOCALISATION ELECTRONIQUE ET DESCRIPTION DES INTERACTIONS DE SURFACEWHITTEN JL; PAKKANEN TA.1980; PHYS. REV. B; ISSN 0163-1829; USA; DA. 1980; VOL. 21; NO 10; PP. 4357-4367; BIBL. 53 REF.Article

CORRELATED-WAVE-FUNCTION CALCULATION OF THE CHEMISORPTION OF CO ON TI(0001) = CALCUL PAR FONCTION D'ONDE CORRELEE DE LA CHIMISORPTION DE CO SUR TI(0001)FISCHER CR; BURKE LA; WHITTEN JL et al.1982; PHYS. REV. LETT.; ISSN 0031-9007; USA; DA. 1982; VOL. 49; NO 5; PP. 344-347; BIBL. 6 REF.Article

MULTIPHOTON IONIZATION SPECTROSCOPY: A THEORETICAL ANALYSIS OF THE NO SPECTRUMCREMASCHI P; JOHNSON PM; WHITTEN JL et al.1978; J. CHEM. PHYS.; USA; DA. 1978; VOL. 69; NO 10; PP. 4341-4348; BIBL. 19 REF.Article

THE STRUCTURE OF THE CARBON DIOXIDE DIMER.BRIGOT N; ODIOT S; WALMSLEY SH et al.1977; CHEM. PHYS. LETTERS; NETHERL.; DA. 1977; VOL. 49; NO 1; PP. 157-159; BIBL. 13 REF.Article

AB INITIO CONFIGURATION INTERACTION STUDIES OF THE ELECTRONIC STATES OF S₂N₂.JAFRI JA; NEWTON MD; PAKKANEN TA et al.1977; J. CHEM. PHYS.; U.S.A.; DA. 1977; VOL. 66; NO 11; PP. 5167-5172; BIBL. 22 REF.Article