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Giovanni Scalmani

Showing results (11-20 of 74) with videos related to

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The Journal of Chemical Physics|October 17, 2014
How far do electrons delocalize?Benjamin G Janesko, Giovanni Scalmani, Michael J Frisch
Physical Chemistry Chemical Physics : PCCP|May 22, 2015
Quantifying solvated electrons' delocalizationBenjamin G Janesko, Giovanni Scalmani, Michael J Frisch
The Journal of Chemical Physics|November 3, 2020
Calculation of magnetic properties with density functional approximations including rung 3.5 ingredientsGiovanni Scalmani, Michael J Frisch, Benjamin G Janesko
Journal of Chemical Theory and Computation|November 18, 2015
Electronic Couplings for Resonance Energy Transfer from CCSD Calculations: From Isolated to Solvated SystemsMarco Caricato, Carles Curutchet, Benedetta Mennucci, et al.
Journal of Computational Chemistry|April 1, 2003
Energies, structures, and electronic properties of molecules in solution with the C-PCM solvation modelMaurizio Cossi, Nadia Rega, Giovanni Scalmani, et al.
The Journal of Chemical Physics|July 24, 2014
Practical auxiliary basis implementation of Rung 3.5 functionalsBenjamin G Janesko, Giovanni Scalmani, Michael J Frisch
Journal of Chemical Theory and Computation|December 15, 2015
Quantifying Electron Delocalization in ElectridesBenjamin G Janesko, Giovanni Scalmani, Michael J Frisch
Journal of Chemical Theory and Computation|December 1, 2015
On the Calculation of Vibrational Frequencies for Molecules in Solution Beyond the Harmonic ApproximationChiara Cappelli, Susanna Monti, Giovanni Scalmani, et al.
Journal of Chemical Theory and Computation|September 12, 2019
Quantum Calculations in Solution of Energies, Structures, and Properties with a Domain Decomposition Polarizable Continuum ModelMichele Nottoli, Benjamin Stamm, Giovanni Scalmani, et al.
Journal of Chemical Theory and Computation|February 1, 2018
Excited State Dipole Moments in Solution: Comparison between State-Specific and Linear-Response TD-DFT ValuesCiro Achille Guido, Benedetta Mennucci, Giovanni Scalmani, et al.
Pageof 8

Showing results (11-20 of 74) with videos related to

Sort By:
Pageof 8
The Journal of Chemical Physics|October 17, 2014
How far do electrons delocalize?Benjamin G Janesko, Giovanni Scalmani, Michael J Frisch
Physical Chemistry Chemical Physics : PCCP|May 22, 2015
Quantifying solvated electrons' delocalizationBenjamin G Janesko, Giovanni Scalmani, Michael J Frisch
The Journal of Chemical Physics|November 3, 2020
Calculation of magnetic properties with density functional approximations including rung 3.5 ingredientsGiovanni Scalmani, Michael J Frisch, Benjamin G Janesko
Journal of Chemical Theory and Computation|November 18, 2015
Electronic Couplings for Resonance Energy Transfer from CCSD Calculations: From Isolated to Solvated SystemsMarco Caricato, Carles Curutchet, Benedetta Mennucci, et al.
Journal of Computational Chemistry|April 1, 2003
Energies, structures, and electronic properties of molecules in solution with the C-PCM solvation modelMaurizio Cossi, Nadia Rega, Giovanni Scalmani, et al.
The Journal of Chemical Physics|July 24, 2014
Practical auxiliary basis implementation of Rung 3.5 functionalsBenjamin G Janesko, Giovanni Scalmani, Michael J Frisch
Journal of Chemical Theory and Computation|December 15, 2015
Quantifying Electron Delocalization in ElectridesBenjamin G Janesko, Giovanni Scalmani, Michael J Frisch
Journal of Chemical Theory and Computation|December 1, 2015
On the Calculation of Vibrational Frequencies for Molecules in Solution Beyond the Harmonic ApproximationChiara Cappelli, Susanna Monti, Giovanni Scalmani, et al.
Journal of Chemical Theory and Computation|September 12, 2019
Quantum Calculations in Solution of Energies, Structures, and Properties with a Domain Decomposition Polarizable Continuum ModelMichele Nottoli, Benjamin Stamm, Giovanni Scalmani, et al.
Journal of Chemical Theory and Computation|February 1, 2018
Excited State Dipole Moments in Solution: Comparison between State-Specific and Linear-Response TD-DFT ValuesCiro Achille Guido, Benedetta Mennucci, Giovanni Scalmani, et al.
Pageof 8