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Ciofini

Showing results (21-30 of 243) with videos related to

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Physical Chemistry Chemical Physics : PCCP|October 29, 2013
Evaluating push-pull dye efficiency using TD-DFT and charge transfer indicesGregorio García, Carlo Adamo, Ilaria Ciofini
Journal of Chemical Theory and Computation|March 19, 2026
Gaussian Charge-Based Electrostatic Embedding Scheme for Solid-State Excited-State ModelingAlexandre Huguet, Ilaria Ciofini, Frédéric Labat
The Journal of Chemical Physics|October 12, 2004
Complete structural and magnetic characterization of biological radicals in solution by an integrated quantum mechanical approach: glycyl radical as a case studyIlaria Ciofini, Carlo Adamo, Vincenzo Barone
The Journal of Chemical Physics|January 10, 2006
Effect of self-interaction error in the evaluation of the bond length alternation in trans-polyacetylene using density-functional theoryI Ciofini, C Adamo, H Chermette
The Journal of Chemical Physics|July 23, 2004
Performance of the tau-dependent functionals in predicting the magnetic coupling of ionic antiferromagnetic insulatorsIlaria Ciofini, Francesc Illas, Carlo Adamo
Physical Chemistry Chemical Physics : PCCP|October 11, 2016
Modelling photophysical properties of metal-organic frameworks: a density functional theory based approachLiam Wilbraham, François-Xavier Coudert, Ilaria Ciofini
Journal of Chemical Theory and Computation|November 26, 2015
A Qualitative Index of Spatial Extent in Charge-Transfer ExcitationsTangui Le Bahers, Carlo Adamo, Ilaria Ciofini
Chemistry (Weinheim an Der Bergstrasse, Germany)|April 9, 2026
When Light Challenges Heat: Mechanistic Insights Into a Reaction Competing With Cadogan Cyclisation in Nitro-PerylenediimidesManuel Pedrón Laserna, Ilaria Ciofini, Piétrick Hudhomme
The Journal of Physical Chemistry. A|April 21, 2010
Photophysical properties of 8-hydroxyquinoline-5-sulfonic acid as a function of the pH: a TD-DFT investigationTangui Le Bahers, Carlo Adamo, Ilaria Ciofini
The Journal of Physical Chemistry Letters|August 20, 2015
Impact of Vibronic Couplings on Perceived Colors: Two Anthraquinones as a Working ExampleDenis Jacquemin, Eric Brémond, Ilaria Ciofini, et al.
Pageof 25

Showing results (21-30 of 243) with videos related to

Sort By:
Pageof 25
Physical Chemistry Chemical Physics : PCCP|October 29, 2013
Evaluating push-pull dye efficiency using TD-DFT and charge transfer indicesGregorio García, Carlo Adamo, Ilaria Ciofini
Journal of Chemical Theory and Computation|March 19, 2026
Gaussian Charge-Based Electrostatic Embedding Scheme for Solid-State Excited-State ModelingAlexandre Huguet, Ilaria Ciofini, Frédéric Labat
The Journal of Chemical Physics|October 12, 2004
Complete structural and magnetic characterization of biological radicals in solution by an integrated quantum mechanical approach: glycyl radical as a case studyIlaria Ciofini, Carlo Adamo, Vincenzo Barone
The Journal of Chemical Physics|January 10, 2006
Effect of self-interaction error in the evaluation of the bond length alternation in trans-polyacetylene using density-functional theoryI Ciofini, C Adamo, H Chermette
The Journal of Chemical Physics|July 23, 2004
Performance of the tau-dependent functionals in predicting the magnetic coupling of ionic antiferromagnetic insulatorsIlaria Ciofini, Francesc Illas, Carlo Adamo
Physical Chemistry Chemical Physics : PCCP|October 11, 2016
Modelling photophysical properties of metal-organic frameworks: a density functional theory based approachLiam Wilbraham, François-Xavier Coudert, Ilaria Ciofini
Journal of Chemical Theory and Computation|November 26, 2015
A Qualitative Index of Spatial Extent in Charge-Transfer ExcitationsTangui Le Bahers, Carlo Adamo, Ilaria Ciofini
Chemistry (Weinheim an Der Bergstrasse, Germany)|April 9, 2026
When Light Challenges Heat: Mechanistic Insights Into a Reaction Competing With Cadogan Cyclisation in Nitro-PerylenediimidesManuel Pedrón Laserna, Ilaria Ciofini, Piétrick Hudhomme
The Journal of Physical Chemistry. A|April 21, 2010
Photophysical properties of 8-hydroxyquinoline-5-sulfonic acid as a function of the pH: a TD-DFT investigationTangui Le Bahers, Carlo Adamo, Ilaria Ciofini
The Journal of Physical Chemistry Letters|August 20, 2015
Impact of Vibronic Couplings on Perceived Colors: Two Anthraquinones as a Working ExampleDenis Jacquemin, Eric Brémond, Ilaria Ciofini, et al.
Pageof 25