Sfoglia per Titolo
Integral-direct coupled cluster calculations of frequency-dependent polarizabilities, transition probabilities and excited-state properties
1998 Christiansen, Ove; Halkier, Asger; Koch, Henrik; Jørgensen, Poul; Helgaker, Trygve
The integral-direct coupled cluster singles and doubles model
1996 Koch, Henrik; De Merás, Alfredo Sánchez; Helgaker, Trygve; Christiansen, Ove
Integrated Approach for Modeling the Emission Fluorescence of 4-(N,N-Dimethylamino)benzonitrile in Polar Environments
2008 S., Carlotto; A., Polimeno; C., Ferrante; C., Benzi; Barone, Vincenzo
Integrated computational approach to vibrationally resolved electronic spectra: anisole as a test case
2008 Bloino, J.; Biczysko, M.; Crescenzi, O.; Barone, Vincenzo
An integrated computational approach for the modeling of CW-ESR spectra of free radicals in solution
2006 P., Cimino; A., Polimeno; Barone, Vincenzo
Integrated computational approach to modelling physico-chemical processes of biological and technological relevance
2008 Barone, Vincenzo
Integrated computational approaches for spectroscopic studies of molecular systems in the gas phase and in solution: Pyrimidine as a test case
2012 Biczysko, M.; Bloino, J.; Brancato, Giuseppe; Cacelli, I.; Cappelli, Chiara; Ferretti, A.; Lami, A.; Monti, S.; Pedone, A.; Prampolini, G.; Puzzarini, C.; Santoro, F.; Trani, F.; Villani, G.
Integrated computational strategies for UV/vis spectra of large molecules in solution
2007 Barone, Vincenzo; A., Polimeno
An integrated computational tool to model the broadening of absorption bands of flexible dyes in solution: cationic chromophores as test cases
2014 Benassi, Enrico; Cappelli, Chiara; Benedetta, Carlotti; Barone, Vincenzo
Integrated experimental and computational spectroscopy study on p-stacking interaction: the anisole dimer
2010 N., Schiccheri; M., Pasquini; G., Piani; G., Pietraperzia; M., Becucci; M., Biczysko; Barone, Vincenzo
An integrated experimental and quantum-chemical investigation on the vibrational spectra of chlorofluoromethane
2013 Andrea Pietropolli Charmet, ; Paolo, Stoppa; Tasinato, Nicola; Santi, Giorgianni; Barone, Vincenzo; Malgorzata, Biczysko; Bloino, JULIEN ROLAND MICHEL; Cappelli, Chiara; Ivan, Carnimeo; Cristina, Puzzarini
Integrated experimental and theoretical approach for the structural characterization of Hg2+aqueous solutions
2008 P., D'Angelo; V., Migliorati; Mancini, Giordano; Barone, Vincenzo; G., Chillemi
An integrated hospital-district performance evaluation for communicable diseases in low- and middle-income countries: Evidence from a pilot in three sub-Saharan countries
2022 Tavoschi, L.; Belardi, P.; Mazzilli, Sara; Manenti, F.; Pellizzer, G.; Abebe, D.; Azzimonti, G.; Nsubuga, J. B.; Dall'Oglio, G.; Vainieri, M.
An integrated interpretable Machine Learning Framework for high-dimensional multi-omics datasets
2023 Onoja, Anthony
Integrated Multiscale Multilevel Approach to Open Shell Molecular Systems
2023 Giovannini, Tommaso; Marrazzini, Gioia; Scavino, Marco; Koch, Henrik; Cappelli, Chiara
Integrated NMR and computational study of push-pull NLO probes: interplay of solvent and structural effects
2011 Marini, Alberto; Macchi, Sara; Jurinovich, Sandro; Catalano, Donata; Mennucci, Benedetta
Integrated QM/MM approaches to the study of structure, dynamics and optical properties of molecules in complex environments
2015 DE MITRI, Nicola
Integrated QM/polarizable MM/continuum approaches to model chiroptical properties of strongly interacting solute-solvent systems
2016 Cappelli, Chiara
Integrated SICM-AFM-optical microscope to measure forces due to hydrostatic pressure applied to a pipette
2012 Pellegrino, M; Orsini, P; Pellegrini, Monica; Baschieri, P; Dinelli, F; Petracchi, D; Tognoni, E; Ascoli, C.
Integrating Work and Political Economy
2015 Riain, Seán Ó; Behling, Felix; Ciccia, Rossella; Flaherty, Eoin
Legenda icone
- file ad accesso aperto
- file disponibili sulla rete interna
- file disponibili agli utenti autorizzati
- file non ad Accesso aperto
- file sotto embargo
- nessun file disponibile