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The Journal of Chemical Physics
|
August 2, 2013
A comparison between state-specific and linear-response formalisms for the calculation of vertical electronic transition energy in solution with the CCSD-PCM method
Marco Caricato
Journal of Chemical Theory and Computation
|
November 24, 2015
Exploring Potential Energy Surfaces of Electronic Excited States in Solution with the EOM-CCSD-PCM Method
Marco Caricato
The Journal of Chemical Physics
|
August 25, 2011
CCSD-PCM: improving upon the reference reaction field approximation at no cost
Marco Caricato
The Journal of Chemical Physics
|
October 23, 2020
Origin invariant optical rotation in the length dipole gauge without London atomic orbitals
Marco Caricato
The Journal of Chemical Physics
|
April 9, 2018
Linear response coupled cluster theory with the polarizable continuum model within the singles approximation for the solvent response
Marco Caricato
The Journal of Chemical Physics
|
September 28, 2013
Implementation of the CCSD-PCM linear response function for frequency dependent properties in solution: application to polarizability and specific rotation
Marco Caricato
The Journal of Physical Chemistry. A
|
January 31, 2024
A Perspective on the Simulation of Electronic Circular Dichroism and Circularly Polarized Luminescence Spectra in Chiral Solid Materials
Marco Caricato
Journal of Chemical Theory and Computation
|
February 19, 2016
Orbital Analysis of Molecular Optical Activity Based on Configuration Rotatory Strength
Marco Caricato
The Journal of Physical Chemistry. A
|
July 14, 2015
Conformational Effects on Specific Rotation: A Theoretical Study Based on the S̃k Method
Marco Caricato
Journal of Chemical Theory and Computation
|
November 26, 2015
Absorption and Emission Spectra of Solvated Molecules with the EOM-CCSD-PCM Method
Marco Caricato
Page
of 17
Search research articles
Search
Showing results (1-10 of 162) with videos related to
Sort By:
Page
of 17
The Journal of Chemical Physics
|
August 2, 2013
A comparison between state-specific and linear-response formalisms for the calculation of vertical electronic transition energy in solution with the CCSD-PCM method
Marco Caricato
Journal of Chemical Theory and Computation
|
November 24, 2015
Exploring Potential Energy Surfaces of Electronic Excited States in Solution with the EOM-CCSD-PCM Method
Marco Caricato
The Journal of Chemical Physics
|
August 25, 2011
CCSD-PCM: improving upon the reference reaction field approximation at no cost
Marco Caricato
The Journal of Chemical Physics
|
October 23, 2020
Origin invariant optical rotation in the length dipole gauge without London atomic orbitals
Marco Caricato
The Journal of Chemical Physics
|
April 9, 2018
Linear response coupled cluster theory with the polarizable continuum model within the singles approximation for the solvent response
Marco Caricato
The Journal of Chemical Physics
|
September 28, 2013
Implementation of the CCSD-PCM linear response function for frequency dependent properties in solution: application to polarizability and specific rotation
Marco Caricato
The Journal of Physical Chemistry. A
|
January 31, 2024
A Perspective on the Simulation of Electronic Circular Dichroism and Circularly Polarized Luminescence Spectra in Chiral Solid Materials
Marco Caricato
Journal of Chemical Theory and Computation
|
February 19, 2016
Orbital Analysis of Molecular Optical Activity Based on Configuration Rotatory Strength
Marco Caricato
The Journal of Physical Chemistry. A
|
July 14, 2015
Conformational Effects on Specific Rotation: A Theoretical Study Based on the S̃k Method
Marco Caricato
Journal of Chemical Theory and Computation
|
November 26, 2015
Absorption and Emission Spectra of Solvated Molecules with the EOM-CCSD-PCM Method
Marco Caricato
Page
of 17