Sfoglia per Autore
PERTURBATION CALCULATIONS OF MOLECULAR INTERACTION ENERGIES - AN EXAMPLE, HF=HF
1986-01-01 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
A MATRIX PARTITIONING APPROACH TO THE CALCULATION OF INTERMOLECULAR POTENTIALS - GENERAL-THEORY AND SOME EXAMPLES
1990-01-01 Amovilli, Claudio; Mcweeny, R.
TEMPERATURE-DEPENDENCE OF THE SLATER SUM - GENERALIZATION OF THE ONE-DIMENSIONAL THOMAS-FERMI THEORY
1991-01-01 Amovilli, Claudio; March, Nh
NONRELATIVISTIC CURRENT-DENSITY FOR ATOMS IN ARBITRARILY STRONG MAGNETIC-FIELDS
1991-01-01 Amovilli, Claudio; March, Nh
MODEL OF CONFINED ATOMS IN ARBITRARY STATIC ELECTRIC-FIELDS - RELEVANCE TO NONDEGENERATE PLASMAS
1991-01-01 Amovilli, Claudio; March, Nh; Pfalzner, S.
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.
SHAPE AND SIMILARITY: TWO ASPECTS OF MOLECULAR RECOGNITION
1991-01-01 Amovilli, Claudio; Mcweeny, R.
Calculation of the dispersion energy contribution to the solvation free energy
1994-01-01 Amovilli, Claudio
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.
Slater sum and kinetic energy tensor in some simple inhomogeneous electron liquids
1995-01-01 Amovilli, Claudio; March, N. H.
Core-Hole States and the Koopmans Theorem
1996-01-01 Amovilli, Claudio; Mcweeny, R.
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 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
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
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
Slater sum and modification of two-dimensional free-electron density of states from the canonical density matrix describing the Aharonov-Bohm effect
1998-01-01 Amovilli, Claudio; March, N. H.
MCSCF study of the S(N)2 Menshutkin reaction in aqueous solution within the polarizable continuum model
1998-01-01 Amovilli, Claudio; Mennucci, Benedetta; Floris, FRANCA MARIA
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