BOVI, DANIELE
BOVI, DANIELE
DIPARTIMENTO DI FISICA
Environmental effects on vibrational properties of carotenoids: Experiments and calculations on peridinin
2011 Bovi, Daniele; Alberto, Mezzetti; Rodolphe, Vuilleumier; Marie Pierre, Gaigeot; Bertrand, Chazallon; Riccardo, Spezia; Guidoni, Leonardo
Fermi Resonance as a Tool for Probing Peridinin Environment
2014 Elizabeth, Kish; Maria Manuela Mendes, Pinto; Bovi, Daniele; Marie, Basire; Guidoni, Leonardo; Rodolphe, Vuilleumier; Bruno, Robert; Riccardo, Spezia; Alberto, Mezzetti
Magnetic coupling constants and vibrational frequencies by extended broken symmetry approach with hybrid functionals
2012 Bovi, Daniele; Guidoni, Leonardo
Magnetic interactions in the catalyst used by nature to split water: a DFT plus U multiscale study on the Mn4CaO5 core in photosystem II
2014 Bovi, Daniele; Narzi, Daniele; Guidoni, Leonardo
Pathway for Mn-cluster oxidation by tyrosine-Z in the S2 state of photosystem II
2014 Narzi, Daniele; Bovi, Daniele; Guidoni, Leonardo
Prediction of Infrared Spectra of Ionic Liquids with ab initio Molecular Dynamics
2015 Bencivenni, Luigi; Bodo, Enrico; Bovi, Daniele; Campetella, Marco; Guidoni, Leonardo; Gontrani, Lorenzo; Masci, Giancarlo; Lupi, Stefano; Ramondo, Fabio; Tanzi, Luana
Structural and vibrational study of 2-MethoxyEthylAmmonium nitrate (2-OMeEAN): interpretation of experimental results with ab initio molecular dynamics
2016 Campetella, M.; Bovi, D.; Caminiti, R.; Guidoni, L.; Bencivenni, L.; Gontrani, L.
The impact of nitric oxide toxicity on the evolution of the glutathione transferase superfamily: A proposal for an evolutionary driving force
2013 A., Bocedi; R., Fabrini; A., Farrotti; L., Stella; A. J., Ketterman; J. Z., Pedersen; N., Allocati; P. C. K., Lau; S., Grosse; L. D., Eltis; A., Ruzzini; T. E., Edwards; L., Morici; E. D., Grosso; Guidoni, Leonardo; Bovi, Daniele; M. L., Bello; G., Federici; M. W., Parker; P. G., Board; G., Ricci
The S-2 State of the Oxygen-Evolving Complex of Photosystem II Explored by QM/MM Dynamics: Spin Surfaces and Metastable States Suggest a Reaction Path Towards the S-3 State
2013 Bovi, Daniele; Narzi, Daniele; Guidoni, Leonardo
Vibrational Signature of Water Molecules in Asymmetric Hydrogen Bonding Environments
2013 Chao, Zhang; Rustam Z., Khaliullin; Bovi, Daniele; Guidoni, Leonardo; Thomas D., Kuhne
Vibrational Spectroscopy of Biomolecules by mixed Quantum/Classical Molecular Dynamics
2011 Bovi, Daniele; Riccardo, Spezia; Alberto, Mezzetti; Rodolphe, Vuilleumier; M. p., Gaigeot; Guidoni, Leonardo
| Titolo | Data di pubblicazione | Autore(i) | File |
|---|---|---|---|
| Environmental effects on vibrational properties of carotenoids: Experiments and calculations on peridinin | 2011 | Bovi, Daniele; Alberto, Mezzetti; Rodolphe, Vuilleumier; Marie Pierre, Gaigeot; Bertrand, Chazallon; Riccardo, Spezia; Guidoni, Leonardo | |
| Fermi Resonance as a Tool for Probing Peridinin Environment | 2014 | Elizabeth, Kish; Maria Manuela Mendes, Pinto; Bovi, Daniele; Marie, Basire; Guidoni, Leonardo; Rodolphe, Vuilleumier; Bruno, Robert; Riccardo, Spezia; Alberto, Mezzetti | |
| Magnetic coupling constants and vibrational frequencies by extended broken symmetry approach with hybrid functionals | 2012 | Bovi, Daniele; Guidoni, Leonardo | |
| Magnetic interactions in the catalyst used by nature to split water: a DFT plus U multiscale study on the Mn4CaO5 core in photosystem II | 2014 | Bovi, Daniele; Narzi, Daniele; Guidoni, Leonardo | |
| Pathway for Mn-cluster oxidation by tyrosine-Z in the S2 state of photosystem II | 2014 | Narzi, Daniele; Bovi, Daniele; Guidoni, Leonardo | |
| Prediction of Infrared Spectra of Ionic Liquids with ab initio Molecular Dynamics | 2015 | Bencivenni, Luigi; Bodo, Enrico; Bovi, Daniele; Campetella, Marco; Guidoni, Leonardo; Gontrani, Lorenzo; Masci, Giancarlo; Lupi, Stefano; Ramondo, Fabio; Tanzi, Luana | |
| Structural and vibrational study of 2-MethoxyEthylAmmonium nitrate (2-OMeEAN): interpretation of experimental results with ab initio molecular dynamics | 2016 | Campetella, M.; Bovi, D.; Caminiti, R.; Guidoni, L.; Bencivenni, L.; Gontrani, L. | |
| The impact of nitric oxide toxicity on the evolution of the glutathione transferase superfamily: A proposal for an evolutionary driving force | 2013 | A., Bocedi; R., Fabrini; A., Farrotti; L., Stella; A. J., Ketterman; J. Z., Pedersen; N., Allocati; P. C. K., Lau; S., Grosse; L. D., Eltis; A., Ruzzini; T. E., Edwards; L., Morici; E. D., Grosso; Guidoni, Leonardo; Bovi, Daniele; M. L., Bello; G., Federici; M. W., Parker; P. G., Board; G., Ricci | |
| The S-2 State of the Oxygen-Evolving Complex of Photosystem II Explored by QM/MM Dynamics: Spin Surfaces and Metastable States Suggest a Reaction Path Towards the S-3 State | 2013 | Bovi, Daniele; Narzi, Daniele; Guidoni, Leonardo | |
| Vibrational Signature of Water Molecules in Asymmetric Hydrogen Bonding Environments | 2013 | Chao, Zhang; Rustam Z., Khaliullin; Bovi, Daniele; Guidoni, Leonardo; Thomas D., Kuhne | |
| Vibrational Spectroscopy of Biomolecules by mixed Quantum/Classical Molecular Dynamics | 2011 | Bovi, Daniele; Riccardo, Spezia; Alberto, Mezzetti; Rodolphe, Vuilleumier; M. p., Gaigeot; Guidoni, Leonardo |