Filippo Lipparini

University of Pisa — Italy

Physics and Astronomy · Physical Sciences

35h-index5.2kcitations170works4.82yr avg
OpenAlex↗ORCID↗Google Scholar↗Lab page↗

Accepting Students?

No reports yet. Know if this professor is taking students?

Research Topics

Advanced Chemical Physics Studies(83), Spectroscopy and Quantum Chemical Studies(79), Photochemistry and Electron Transfer Studies(35), Advanced NMR Techniques and Applications(30), Molecular spectroscopy and chirality(16)

Publications170 total

Excitation Energies in a Polarizable Environment: A Comparison of State-Averaged and Linear-Response CASSCF/AMOEBA formulations
2025
Multicomponent Synthesis on a Diiron Platform of Stable Ferrabenzenes with Promising Anticancer Activity
Angewandte Chemie International Edition·2025· 2 citedOpen Access
Multicomponent Synthesis on a Diiron Platform of Stable Ferrabenzenes with Promising Anticancer Activity
Angewandte Chemie·2025
An Efficient and Robust Implementation of CASSCF Linear Response Theory
The Journal of Physical Chemistry A·2025
QUEST Database of Highly-Accurate Excitation Energies
Journal of Chemical Theory and Computation·2025· 12 citedOpen Access
Correction to “Heptazine, Cyclazine, and Related Compounds: Chemically-Accurate Estimates of the Inverted Singlet–Triplet Gap”
The Journal of Physical Chemistry Letters·2025· 4 citedOpen Access
Extending the <scp>MST</scp> Model to Large Biomolecular Systems: Parametrization of the <scp>ddCOSMO</scp> ‐ <scp>MST</scp> Continuum Solvation Model
Journal of Computational Chemistry·2025· 2 citedOpen Access
A Polarizable CASSCF/MM Approach Using the Interface Between OpenMMPol Library and Cfour
Journal of Computational Chemistry·2024· 4 citedOpen Access
A polarizable CASSCF/MM approach using the interface between OpenMMPol library and CFour
arXiv (Cornell University)·2024Open Access
Cholesky Decomposition in Spin-Free Dirac–Coulomb Coupled-Cluster Calculations
The Journal of Physical Chemistry A·2024· 9 cited
Reference CC3 Excitation Energies for Organic Chromophores: Benchmarking TD-DFT, BSE/<i>GW</i>, and Wave Function Methods
Journal of Chemical Theory and Computation·2024· 17 cited
Importance of Polarizable Embedding for Computing Optical Rotation: The Case of Camphor in Ethanol
The Journal of Physical Chemistry Letters·2024· 4 citedOpen Access
Geometric Optimization of Restricted-Open and Complete Active Space Self-Consistent Field Wave Functions
The Journal of Physical Chemistry A·2024· 5 cited
Transition Metal‐Driven Selectivity in Direct C−H Arylation of Imidazo[2,1‐<i>b</i>]Thiazole
ChemistryOpen·2024· 2 citedOpen Access
Reference CC3 Excitation Energies for Organic Chromophores: Benchmarking TD-DFT, BSE/$GW$ and Wave Function Methods
arXiv (Cornell University)·2024· 1 citedOpen Access
ddX: Polarizable continuum solvation from small molecules to proteins
Wiley Interdisciplinary Reviews Computational Molecular Science·2024· 8 citedOpen Access
Cholesky decomposition in spin-free Dirac-Coulomb coupled-cluster calculations
arXiv (Cornell University)·2024Open Access
ddX: Polarizable Continuum Solvation from Small Molecules to Proteins
2024Open Access
MBE-CASSCF Approach for the Accurate Treatment of Large Active Spaces
Journal of Chemical Theory and Computation·2024· 10 citedOpen Access
Raman, surface‐enhanced Raman and density functional theory analyses of poorly soluble pharmaceuticals in water
Microchemical Journal·2024· 1 citedOpen Access
page 1 of 9Next →

Frequent Co-authors

Benedetta Mennucci(22), Louis Lagardère(13), Jean‐Philip Piquemal(12), Benjamin Stamm(10), Vincenzo Barone(10), Giovanni Scalmani(9), Éric Cancès(9), Chiara Cappelli(8), Lorenzo Cupellini(6), Michael J. Frisch(6), Jürgen Gauß(5), Michele Nottoli(5), Yvon Maday(5), Michael J. Schnieders(4), Yvon Maday(4), Pengyu Ren(4), Pierre‐François Loos(4), Denis Jacquemin(4), Daniele Loco(4), Stefano Caprasecca(4)