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Physics of Life Reviews|July 20, 2019
A never-ending story in the sky: The secrets of chemical evolutionCristina Puzzarini, Vincenzo BaroneJournal of Chemical Theory and Computation|August 31, 2024
Accurate Vibrational and Ro-Vibrational Contributions to the Properties of Large Molecules by a New Engine Employing Curvilinear Internal Coordinates and Vibrational Perturbation Theory to Second OrderMarco Mendolicchio, Vincenzo BaroneJournal of Chemical Theory and Computation|September 17, 2024
Reconciling Accuracy and Feasibility for Barrierless Reaction Steps by the PCS/DDCI/MC-PDFT Protocol: Methane and Ethylene Dissociations as Case StudiesLuigi Crisci, Vincenzo BaroneTopics in Current Chemistry|March 21, 2014
Excited states behavior of nucleobases in solution: insights from computational studiesRoberto Improta, Vincenzo BaronePhysical Chemistry Chemical Physics : PCCP|December 22, 2009
On the stability of X2NO radicals (X = F, Cl, Br, I)Cristina Puzzarini, Vincenzo BaroneJournal of Chemical Theory and Computation|November 20, 2015
Computational Chemistry Meets Experiments for Explaining the Behavior of Bibenzyl: A Thermochemical and Spectroscopic (Infrared, Raman, and NMR) InvestigationCamille Latouche, Vincenzo BaronePhysical Chemistry Chemical Physics : PCCP|March 5, 2010
Unraveling solvent effects on the electronic absorption spectra of TRITC fluorophore in solution: a theoretical TD-DFT/PCM studyAlfonso Pedone, Vincenzo BaronePhysical Chemistry Chemical Physics : PCCP|March 17, 2011
Extending the molecular size in accurate quantum-chemical calculations: the equilibrium structure and spectroscopic properties of uracilCristina Puzzarini, Vincenzo BaroneJournal of the American Chemical Society|November 4, 2004
Absorption and fluorescence spectra of uracil in the gas phase and in aqueous solution: a TD-DFT quantum mechanical studyRoberto Improta, Vincenzo BaronePhysical Chemistry Chemical Physics : PCCP|November 26, 2008
Assessment of a computational strategy approaching spectroscopic accuracy for structure, magnetic properties and vibrational frequencies of organic free radicals: the F(2)CN and F(2)BO caseCristina Puzzarini, Vincenzo BaronePageof 50