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Mostrati risultati da 1 a 20 di 236
Titolo Data di pubblicazione Autori File
Molecular orbital description of core excitation spectra in transition metal compounds. An ab-initio CI calculation on TiCl4 and isoelectronic molecules 1-gen-1994 DECLEVA, PIETROFRONZONI, GIOVANNASTENER, MAURO +
LCAO density functional calculations of core binding energy shifts of large molecules 1-gen-1994 STENER, MAURODECLEVA, PIETRO +
Accurate local density photoionization cross sections by LCAO Stieltjes Imaging approach 1-gen-1995 STENER, MAURODECLEVA, PIETRO +
DENSITY FUNCTIONAL CALCULATIONS OF EXCITATIONS ENERGIES AND OSCILLATOR STRENGTHS FOR C1S->pi* AND O1S->pi* EXCITATIONS AND IONIZATION POTENTIALS IN CARBONYL CONTAINING MOLECULES 1-gen-1995 STENER, MAURODECLEVA, PIETRO +
Density Functional - Time Dependent Local Density Approximation Calculations of Autoionization Resonances in Noble Gases 1-gen-1995 STENER, MAURODECLEVA, PIETRO +
Molecular photoionization cross sections by the local density LCAO Stieltjes Imaging approach 1-gen-1995 STENER, MAURODECLEVA, PIETRO +
Calculations of giant resonances and cross section profiles of valence ionizations of cubane by LCAO density functional Stieltjes imaging approach 1-gen-1995 STENER, MAURODECLEVA, PIETRO +
Ab initio and Density Functional calculations of core excitation spectra of CO, H2CO and F2CO 1-gen-1996 FRONZONI, GIOVANNASTENER, MAURODECLEVA, PIETRO +
NaxAu and CsxAu bimetal clusters: Finite size analogs of sodium-gold and cesium-gold compounds 1-gen-1996 STENER, MAURO +
TDLDA calculations of photoionization cross section and asymmetry parameter profiles of alkaline-earth atoms 1-gen-1997 STENER, MAURODE ALTI, GIANCARLOFRONZONI, GIOVANNADECLEVA, PIETRO
PHOTOIONIZATION OF ZINC BY TDLDA CALCULATIONS 1-gen-1997 STENER, MAURODECLEVA, PIETRO
From Clusters to Bulk. A Relativistic Density Functional Investigation on a series of Gold Clusters Aun, n = 6 ... 147. 1-gen-1997 STENER, MAURO +
Theoretical study of the Cl 1s and 2p near edge photoabsorption spectra of HCl by accurate ab-initio CI and density functional approaches 1-gen-1998 FRONZONI, GIOVANNASTENER, MAURODECLEVA, PIETRODE ALTI, GIANCARLO
Molecular magnetic quantum dots in multivalent metal cluster compounds 1-gen-1998 STENER, MAURO +
Valence photoionization of C6H6 by the B-spline one-centre expansion density functional method 1-gen-1998 STENER, MAURODECLEVA, PIETRO +
Photoionization of first and second row hydrides by the B-spline one-centre expansion density functional method 1-gen-1998 STENER, MAURODECLEVA, PIETRO
Theoretical description of the NEXAFS Cl 1s and 2p spectra of ClF and ClF3 1-gen-1999 FRONZONI, GIOVANNASTENER, MAURODECLEVA, PIETRO
Theoretical study of resonances in the metal core photoionization of M@C60 (M=Li,Na,K) 1-gen-1999 DECLEVA, PIETRODE ALTI, GIANCARLOFRONZONI, GIOVANNASTENER, MAURO
Photoionization of CH4, SiH4, BH3 and AlH3 by the B-spline one-centre expansion density functional method 1-gen-1999 STENER, MAURODECLEVA, PIETRO
Photoionization of M@C60 (M=Li,Na,K) by large scale one centre density functional explicit continuum wavefunction 1-gen-1999 STENER, MAUROFRONZONI, GIOVANNADECLEVA, PIETRO +
Mostrati risultati da 1 a 20 di 236
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