Cesare Pisani

发表

Periodic local MP2 method for the study of electronic correlation in crystals: Theory and preliminary applications

Cesare Pisani, Lorenzo Maschio, Silvia Casassa, 2008, J. Comput. Chem..

ISOLATED AND EMBEDDED-CLUSTER MODELING OF THE OXYGEN VACANCY IN ALPHA-QUARTZ

Cesare Pisani, Vb Sulimov, F. Corà, 1994 .

Evaluation of the electron momentum density of crystalline systems from ab initio linear combination of atomic orbitals calculations

Cesare Pisani, Alessandro Erba, C. Pisani, 2012, J. Comput. Chem..

Abinitio Hartree–Fock perturbed‐cluster treatment of local defects in crystals

Roberto Dovesi, Cesare Pisani, L. Kantorovich, 1990 .

Quantum-Mechanical Ab-initio Calculation of the Properties of Crystalline Materials

Cesare Pisani, C. Pisani, 1996 .

Hartree Fock Ab Initio Treatment of Crystalline Systems

Roberto Dovesi, Cesare Pisani, R. Dovesi, 1988 .

The Periodic Hartree‐Fock Method and Its Implementation in the CRYSTAL Code

Roberto Dovesi, Roberto Orlando, Cesare Pisani, 2000 .

Approaching the theoretical limit in periodic local MP2 calculations with atomic-orbital basis sets: the case of LiH.

Bartolomeo Civalleri, Roberto Dovesi, Cesare Pisani, 2011, The Journal of chemical physics.

Hartree-Fock study of lithium hydride with the use of a polarizable basis set

Roberto Dovesi, Cesare Pisani, E. Ferrero, 1984 .

Exact-exchange Hartree–Fock calculations for periodic systems. I. Illustration of the method†

Roberto Dovesi, Cesare Pisani, R. Dovesi, 1980 .

Embedded cluster ab initio study of the neutral oxygen vacancy in quartz and cristobalite

Cesare Pisani, Silvia Casassa, Vladimir B. Sulimov, 2000 .

CRYSCOR: a program for the post-Hartree-Fock treatment of periodic systems.

Cesare Pisani, Lorenzo Maschio, Silvia Casassa, 2012, Physical chemistry chemical physics : PCCP.

Proton ordered cubic and hexagonal periodic models of ordinary Ice

Cesare Pisani, Silvia Casassa, M. Calatayud, 2005 .

Fast local-MP2 method with density-fitting for crystals. I. Theory and algorithms

Frederick R. Manby, Cesare Pisani, Lorenzo Maschio, 2007 .

Exact–exchange Hartree–Fock calculations for periodic systems

Roberto Dovesi, Cesare Pisani, R. Dovesi, 1981 .

On the Prospective Use of the One-Electron Density Matrix as a Test of the Quality of Post-Hartree–Fock Schemes for Crystals

Cesare Pisani, Lorenzo Maschio, Silvia Casassa, 2006 .

Ab initio study of metallic beryllium

Roberto Dovesi, Cesare Pisani, R. Dovesi, 1982 .

Beyond a Hartree–Fock description of crystalline solids: the case of lithium hydride

Cesare Pisani, Lorenzo Maschio, Silvia Casassa, 2007 .

STRUCTURAL, VIBRATIONAL AND ELECTRONIC-PROPERTIES OF A CRYSTALLINE HYDRATE FROM AB-INITIO PERIODIC HARTREE-FOCK CALCULATIONS

Cesare Pisani, Kersti Hermansson, Mauro Causà, 1994 .

Chemisorption theory in the Hartree-Fock approximation

Cesare Pisani, T. B. Grimley, C. Pisani, 1974 .

Electronic structure of NiO/Ag(100) thin films from DFT+U and hybrid functional DFT approaches

Anna Maria Ferrari, Cesare Pisani, Gianfranco Pacchioni, 2006 .

The electronic structure of α-quartz: A periodic Hartree-Fock calculation

Roberto Dovesi, Cesare Pisani, Bernard Silvi, 1987 .

Fast local-MP2 method with density-fitting for crystals. II. Test calculations and application to the carbon dioxide crystal

Frederick R. Manby, Cesare Pisani, Lorenzo Maschio, 2007 .

Exact-exchange Hartree–Fock calculations for periodic systems. II. Results for graphite and hexagonal boron nitride†

Roberto Dovesi, Cesare Pisani, R. Dovesi, 1980 .

Symmetry-adapted Localized Wannier Functions Suitable for Periodic Local Correlation Methods

Cesare Pisani, Silvia Casassa, Claudio M. Zicovich-Wilson, 2006 .

An ab-initio Hartree-Fock perturbed-cluster study of neutral defects in LiF

C. R. A. Catlow, Roberto Orlando, Cesare Pisani, 1993 .