| Gaussian16; Gaussian, Inc MJ Frisch, GW Trucks, HB Schlegel, GE Scuseria, MA Robb, ... Wallingford, CT, 2016 | 6538* | 2016 |
| Gaussian 09, Revision A. 03, Gaussian, Inc.: Wallingford MJ Frisch, GW Trucks, HB Schlegel, GE Scuseria, MA Robb, ... | 121 | 2016 |
| Implementation of a graphical user interface for the virtual multifrequency spectrometer: The VMS‐Draw tool D Licari, A Baiardi, M Biczysko, F Egidi, C Latouche, V Barone Journal of computational chemistry 36 (5), 321-334, 2015 | 100 | 2015 |
| The optical rotation of methyloxirane in aqueous solution: a never ending story? F Lipparini, F Egidi, C Cappelli, V Barone Journal of Chemical Theory and Computation 9 (4), 1880-1884, 2013 | 99 | 2013 |
| Real time propagation of the exact two component time-dependent density functional theory JJ Goings, JM Kasper, F Egidi, S Sun, X Li The Journal of chemical physics 145 (10), 2016 | 97 | 2016 |
| Two-component noncollinear time-dependent spin density functional theory for excited state calculations F Egidi, S Sun, JJ Goings, G Scalmani, MJ Frisch, X Li Journal of Chemical Theory and Computation 13 (6), 2591-2603, 2017 | 95 | 2017 |
| A robust and effective time-independent route to the calculation of resonance raman spectra of large molecules in condensed phases with the inclusion of Duschinsky, Herzberg … F Egidi, J Bloino, C Cappelli, V Barone Journal of chemical theory and computation 10 (1), 346-363, 2014 | 84 | 2014 |
| Molecular spectroscopy of aqueous solutions: a theoretical perspective T Giovannini, F Egidi, C Cappelli Chemical Society Reviews 49 (16), 5664-5677, 2020 | 83 | 2020 |
| Direct atomic-orbital-based relativistic two-component linear response method for calculating excited-state fine structures F Egidi, JJ Goings, MJ Frisch, X Li Journal of chemical theory and computation 12 (8), 3711-3718, 2016 | 71 | 2016 |
| Gaussian 16, revision C. 01 normal name order MJ Frisch, GW Trucks, HB Schlegel, GE Scuseria, MA Robb, ... Gaussian, 2016 | 58 | 2016 |
| General strategy for computing nonlinear optical properties of large neutral and cationic organic chromophores in solution E Benassi, F Egidi, V Barone The Journal of Physical Chemistry B 119 (7), 3155-3173, 2015 | 58 | 2015 |
| Toward an accurate modeling of optical rotation for solvated systems: Anharmonic vibrational contributions coupled to the polarizable continuum model F Egidi, V Barone, J Bloino, C Cappelli Journal of Chemical Theory and Computation 8 (2), 585-597, 2012 | 56 | 2012 |
| Gaussian 16 GE Scuseria, MA Robb, JR Cheeseman, G Scalmani, V Barone, ... Revision C 1, 2016 | 52 | 2016 |
| Gaussian 16, Revision B. 01 (Gaussian Inc., 2016) MJ Frisch, GW Trucks, HB Schlegel, GE Scuseria, MA Robb, ... There is no corresponding record for this reference, 0 | 51 | |
| Gaussian 16 GW Trucks, HB Schlegel, GE Scuseria, MA Robb, JR Cheeseman, ... Revision B 1, 2016 | 50 | 2016 |
| The consequences of improperly describing oscillator strengths beyond the electric dipole approximation PJ Lestrange, F Egidi, X Li The Journal of Chemical Physics 143 (23), 2015 | 50 | 2015 |
| Polarizable embedding approach for the analytical calculation of Raman and Raman optical activity spectra of solvated systems T Giovannini, M Olszowka, F Egidi, JR Cheeseman, G Scalmani, ... Journal of Chemical Theory and Computation 13 (9), 4421-4435, 2017 | 49 | 2017 |
| Simulating vertical excitation energies of solvated dyes: From continuum to polarizable discrete modeling T Giovannini, M Macchiagodena, M Ambrosetti, A Puglisi, P Lafiosca, ... International Journal of Quantum Chemistry 119 (1), e25684, 2019 | 46 | 2019 |
| Theory and algorithms for chiroptical properties and spectroscopies of aqueous systems T Giovannini, F Egidi, C Cappelli Physical Chemistry Chemical Physics 22 (40), 22864-22879, 2020 | 45 | 2020 |
| The electronic circular dichroism of nicotine in aqueous solution: a test case for continuum and mixed explicit-continuum solvation approaches F Egidi, R Russo, I Carnimeo, A D’Urso, G Mancini, C Cappelli The Journal of Physical Chemistry A 119 (21), 5396-5404, 2015 | 43 | 2015 |
Chiara CappelliScuola Normale SuperioreZweryfikowany adres z sns.it