Silvia Casassa

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..

Electron density analysis of large (molecular and periodic) systems: A parallel implementation

Roberto Orlando, Silvia Casassa, Alessandro Erba, 2015, J. Comput. Chem..

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 .

Quantum‐mechanical condensed matter simulations with CRYSTAL

Bartolomeo Civalleri, Roberto Dovesi, Roberto Orlando, 2018 .

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 .

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

Cesare Pisani, Lorenzo Maschio, Silvia Casassa, 2007 .

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 .

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

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

Calibration of ⁵⁷Fe Mössbauer constants by first principles.

Anna Maria Ferrari, Silvia Casassa, S. Casassa, 2016, Physical chemistry chemical physics : PCCP.