Sfoglia per Autore
PERTURBATION CALCULATIONS OF MOLECULAR INTERACTION ENERGIES - AN EXAMPLE, HF=HF
1986-01-01 Amovilli, Claudio; Mcweeny, R.
A MATRIX PARTITIONING APPROACH TO THE CALCULATION OF INTERMOLECULAR POTENTIALS - GENERAL-THEORY AND SOME EXAMPLES
1990-01-01 Amovilli, Claudio; Mcweeny, R.
CHARACTERIZATION OF POTENTIAL-ENERGY CURVES FOR H-2+ AND H-2 BY LOCAL VALUES OF ELECTRON-DENSITY
1990-01-01 Amovilli, Claudio; March, Nh
SHAPE AND SIMILARITY: TWO ASPECTS OF MOLECULAR RECOGNITION
1991-01-01 Amovilli, Claudio; Mcweeny, R.
MODEL OF CONFINED ATOMS IN ARBITRARY STATIC ELECTRIC-FIELDS - RELEVANCE TO NONDEGENERATE PLASMAS
1991-01-01 Amovilli, Claudio; March, Nh; Pfalzner, S.
TEMPERATURE-DEPENDENCE OF THE SLATER SUM - GENERALIZATION OF THE ONE-DIMENSIONAL THOMAS-FERMI THEORY
1991-01-01 Amovilli, Claudio; March, Nh
CORRELATION-ENERGY AND THE USE OF LINNETT-TYPE ORBITALS IN VB CALCULATIONS FOR BENZENE AND PYRIDINE
1991-01-01 Amovilli, Claudio; Harcourt, Rd; Mcweeny, R.
NONRELATIVISTIC CURRENT-DENSITY FOR ATOMS IN ARBITRARILY STRONG MAGNETIC-FIELDS
1991-01-01 Amovilli, Claudio; March, Nh
Calculation of the dispersion energy contribution to the solvation free energy
1994-01-01 Amovilli, Claudio
Slater sum and kinetic energy tensor in some simple inhomogeneous electron liquids
1995-01-01 Amovilli, Claudio; March, N. H.
Quantum-chemical modelling of CO physisorbed and chemisorbed on a beryllium metal surface
1995-01-01 Amovilli, Claudio; Blazej, M.; March, N. H.
Molecular interactions: a study of charge transfer effects
1995-01-01 Amovilli, Claudio; Mcweeny, R.
Core-Hole States and the Koopmans Theorem
1996-01-01 Amovilli, Claudio; Mcweeny, R.
On the Evaluation of the Matrix Elements Between Non-Orthogonal Slater Determinants
1997-01-01 Amovilli, Claudio
Self Consistent Field Calculation of Pauli Repulsion and Dispersion Contributions to the Solvation Free Energy in the Polarizable Continuum Model
1997-01-01 Amovilli, Claudio; Mennucci, Benedetta
Inhomogeneous Electron Liquid: H Atom Dirac Density Matrix in Limit of Infinite Number of Closed Shells
1997-01-01 Amovilli, Claudio; March, N. H.
On the Effect of Pauli Repulsion and Dispersion on Static Molecular Polarizabilities and Hyperpolarizabilities in Solution
1998-01-01 Mennucci, Benedetta; Amovilli, Claudio; Tomasi, Iacopo
Kinetic Energy Density in Terms of Electron Density for Closed-Shell Atoms in a Bare Coulomb Field
1998-01-01 Amovilli, Claudio; March, N. H.
On the effect of Pauli repulsion and dispersion on static molecular polarizabilities and hyperpolarizabilities in solution
1998-01-01 Mennucci, Benedetta; Amovilli, Claudio; Tomasi, Iacopo
Thomas-Fermi theory of an inhomogeneous electron liquid generalized to incorporate density gradients
1998-01-01 Amovilli, Claudio; March, N. H.; Schmalz, T. G.; Klein, D. J.
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