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Enrico Benassi

Showing results (1-10 of 85) with videos related to

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Journal of Computational Chemistry|November 10, 2021
An inexpensive density functional theory-based protocol to predict accurate <sup>19</sup> F-NMR chemical shiftsEnrico Benassi
Journal of Computational Chemistry|November 1, 2016
Benchmarking of density functionals for a soft but accurate prediction and assignment of (1) H and (13)C NMR chemical shifts in organic and biological moleculesEnrico Benassi
Dalton Transactions (Cambridge, England : 2003)|April 4, 2018
Crystal structure resolution of an insulator due to the cooperative Jahn-Teller effect through Bader's theory: the challenging case of cobaltite oxide Y114Christian Tantardini, Enrico Benassi
Physical Chemistry Chemical Physics : PCCP|October 10, 2017
Topology vs. thermodynamics in chemical reactions: the instability of PH<sub>5</sub>Christian Tantardini, Enrico Benassi
The Journal of Chemical Physics|October 2, 2012
First principle evaluation of the chiroptical activity of the di-phenyl-diazene derivativesEnrico Benassi, Stefano Corni
Langmuir : the ACS Journal of Surfaces and Colloids|July 25, 2013
Structural properties of azobenzene self-assembled monolayers by atomistic simulationsSilvio Pipolo, Enrico Benassi, Stefano Corni
Spectrochimica Acta. Part A, Molecular and Biomolecular Spectroscopy|February 23, 2008
cis peak as probe to investigate the molecular structure. Application to the rotational isomerism of 2,5-diphenylethenyl(hetero)arenesIvan Baraldi, Enrico Benassi, Anna Spalletti
Physical Chemistry Chemical Physics : PCCP|January 10, 2019
The impact on the ring related vibrational frequencies of pyridine of hydrogen bonds with haloforms - a topology perspectiveEnrico Benassi, Kamila Akhmetova, Haiyan Fan
Journal of Computational Chemistry|July 2, 2016
Source function and plane waves: Toward complete bader analysisChristian Tantardini, Davide Ceresoli, Enrico Benassi
Journal of Chemical Theory and Computation|November 18, 2015
A "twist" on the interpretation of the multifluorescence patterns of DASPMIMireia Segado, Enrico Benassi, Vincenzo Barone
Pageof 9

Showing results (1-10 of 85) with videos related to

Sort By:
Pageof 9
Journal of Computational Chemistry|November 10, 2021
An inexpensive density functional theory-based protocol to predict accurate <sup>19</sup> F-NMR chemical shiftsEnrico Benassi
Journal of Computational Chemistry|November 1, 2016
Benchmarking of density functionals for a soft but accurate prediction and assignment of (1) H and (13)C NMR chemical shifts in organic and biological moleculesEnrico Benassi
Dalton Transactions (Cambridge, England : 2003)|April 4, 2018
Crystal structure resolution of an insulator due to the cooperative Jahn-Teller effect through Bader's theory: the challenging case of cobaltite oxide Y114Christian Tantardini, Enrico Benassi
Physical Chemistry Chemical Physics : PCCP|October 10, 2017
Topology vs. thermodynamics in chemical reactions: the instability of PH<sub>5</sub>Christian Tantardini, Enrico Benassi
The Journal of Chemical Physics|October 2, 2012
First principle evaluation of the chiroptical activity of the di-phenyl-diazene derivativesEnrico Benassi, Stefano Corni
Langmuir : the ACS Journal of Surfaces and Colloids|July 25, 2013
Structural properties of azobenzene self-assembled monolayers by atomistic simulationsSilvio Pipolo, Enrico Benassi, Stefano Corni
Spectrochimica Acta. Part A, Molecular and Biomolecular Spectroscopy|February 23, 2008
cis peak as probe to investigate the molecular structure. Application to the rotational isomerism of 2,5-diphenylethenyl(hetero)arenesIvan Baraldi, Enrico Benassi, Anna Spalletti
Physical Chemistry Chemical Physics : PCCP|January 10, 2019
The impact on the ring related vibrational frequencies of pyridine of hydrogen bonds with haloforms - a topology perspectiveEnrico Benassi, Kamila Akhmetova, Haiyan Fan
Journal of Computational Chemistry|July 2, 2016
Source function and plane waves: Toward complete bader analysisChristian Tantardini, Davide Ceresoli, Enrico Benassi
Journal of Chemical Theory and Computation|November 18, 2015
A "twist" on the interpretation of the multifluorescence patterns of DASPMIMireia Segado, Enrico Benassi, Vincenzo Barone
Pageof 9