AMOVILLI, CLAUDIO Statistiche
AMOVILLI, CLAUDIO
DIPARTIMENTO DI CHIMICA E CHIMICA INDUSTRIALE
Can CASSCF model the excited states of xanthophyll lutein? A density matrix renormalization group journey
2026-01-01 Giannì, Ivan; Amovilli, Claudio; Lipparini, Filippo; Pedraza-González, Laura
DMRG/FQ: A Polarizable Embedding Approach Combining Density Matrix Renormalization Group and Fluctuating Charges
2026-01-01 Rinaldi, Matteo; Sepali, Chiara; Kirk, Alicia M.; Amovilli, Claudio; Cappelli, Chiara
Method to Compute the Interaction Energy of a Molecule in Ground and Excited States with a Discrete Environment: The Case of Uracil in Water
2025-01-01 Amovilli, C.; Floris, F. M.
Forcing broken symmetry to recover static electronic correlation: the H2 molecule test case
2024-01-01 Amovilli, C.
Method to Compute the Solute-Solvent Dispersion Contribution to the Electronic Excitation Energy in Solution
2022-01-01 Amovilli, C.; Floris, F. M.
Calculation of potential energy surfaces with quantum Monte Carlo as a useful tool for the design of green chemical syntheses: The HOCO radical test case.
2021-01-01 Amovilli, C.; Floris, F. M.
Extraction of a one-particle reduced density matrix from a quantum monte carlo electronic density: A new tool for studying nondynamic correlation
2021-01-01 Naim, C.; Amovilli, C.
Intermolecular Pauli repulsion: a QMC study of molecules in ground and excited state in free space and in solution
2020-01-01 Floris, F. M.; Amovilli, C.
On the effect of solute-solvent Pauli repulsion on n → π* transition for acrolein in water solution
2020-01-01 Amovilli, C.; Floris, F. M.
Critical conditions (zero ionization potential) in model N_2-like molecular ions
2018-01-01 Amovilli, C.; Floris, F. M.
Many-body Approaches at Different Scales: A Tribute to Norman H. March on the Occasion of his 90th Birthday
2018-01-01 Angilella, G. G. N.; Amovilli, C.
Preface
2018-01-01 Angilella, G. G. N.; Amovilli, C.
Shannon entropy and correlation energy for electrons in atoms
2018-01-01 Amovilli, C.; Floris, F. M.
Shannon Entropy in Atoms: A Test for the Assessment of Density Functionals in Kohn-Sham Theory
2018-01-01 Amovilli, C.; Floris, F. M.
Properties of electron density in weak binding conditions
2017-01-01 Amovilli, C.; March, N. H.
Tallberg, DFT17 Poster A20: Shannon entropy and correlation energy for electrons in atoms
2017-01-01 Floris, F. M.; Amovilli, C.
Variational quantum Monte Carlo results for N2, N2+ and C2– utilising the four-dimensional density of Bright Wilson
2017-01-01 Amovilli, Claudio; March, N. H.
Approaching the s-wave model ground state energy of He-like atomic ions: results from a model Hamiltonian
2016-01-01 Amovilli, Claudio; March, N. H.
Introducing QMC/MMpol: Quantum Monte Carlo in Polarizable Force Fields for Excited States
2016-01-01 Guareschi, Riccardo; Zulfikri, Habiburrahman; Daday, Csaba; Floris, FRANCA MARIA; Amovilli, Claudio; Mennucci, Benedetta; Filippi, Claudia
Localized Polycentric Orbital Basis Set for Quantum Monte Carlo Calculations Derived from the Decomposition of Kohn-Sham Optimized Orbitals
2016-01-01 Amovilli, Claudio; Floris, FRANCA MARIA; Grisafi, Andrea