Search research articles
Contact Us
Filters
Showing results (1-10 of 27) with videos related to
Page
of 3
Sort By:
Journal of Molecular Modeling
|
February 17, 2021
Unveiling the molecular mechanisms of the cycloaddition reactions of aryl hetaryl thioketones and C,N-disubstituted nitrilimines
George Baffour Pipim, Ernest Opoku
Journal of Molecular Graphics & Modelling
|
July 15, 2019
Quantum chemical studies on the mechanistic aspects of tandem sequential cycloaddition reactions of cyclooctatetraene with ester and nitrones
Ernest Opoku, Richard Tia, Evans Adei
Journal of Molecular Modeling
|
May 24, 2019
Computational studies on [4 + 2] / [3 + 2] tandem sequential cycloaddition reactions of functionalized acetylenes with cyclopentadiene and diazoalkane for the formation of norbornene pyrazolines
Ernest Opoku, Richard Tia, Evans Adei
The Journal of Chemical Physics
|
February 10, 2025
Electron-propagator methods versus experimental ionization energies
Ernest Opoku, Filip Pawłowski, J V Ortiz
Physical Chemistry Chemical Physics : PCCP
|
March 14, 2024
New-generation electron-propagator methods for vertical electron detachment energies of molecular anions: benchmarks and applications to model green-fluorescent-protein chromophores
Ernest Opoku, Filip Pawłowski, J V Ortiz
The Journal of Chemical Physics
|
December 2, 2021
A new generation of diagonal self-energies for the calculation of electron removal energies
Ernest Opoku, Filip Pawłowski, J V Ortiz
The Journal of Physical Chemistry. A
|
August 14, 2024
Electron Binding Energies of Open-Shell Species from Diagonal Electron-Propagator Self-Energies with Unrestricted Hartree-Fock Spin-Orbitals
Ernest Opoku, Filip Pawłowski, J V Ortiz
The Journal of Physical Chemistry. A
|
April 7, 2025
Simplified Ring and Ladder Renormalizations in Electron-Propagator Calculations of Molecular Ionization Energies
Ernest Opoku, Filip Pawłowski, J V Ortiz
The Journal of Physical Chemistry. A
|
February 20, 2024
New-Generation Electron-Propagator Methods for Molecular Electron-Binding Energies
Ernest Opoku, Filip Pawłowski, J V Ortiz
The Journal of Physical Chemistry. A
|
May 30, 2024
<i>Ab Initio</i> Electron Propagators with an Hermitian, Intermediately Normalized Superoperator Metric Applied to Vertical Electron Affinities
Ernest Opoku, Filip Pawłowski, J V Ortiz
Page
of 3
Search research articles
Search
Showing results (1-10 of 27) with videos related to
Sort By:
Page
of 3
Journal of Molecular Modeling
|
February 17, 2021
Unveiling the molecular mechanisms of the cycloaddition reactions of aryl hetaryl thioketones and C,N-disubstituted nitrilimines
George Baffour Pipim, Ernest Opoku
Journal of Molecular Graphics & Modelling
|
July 15, 2019
Quantum chemical studies on the mechanistic aspects of tandem sequential cycloaddition reactions of cyclooctatetraene with ester and nitrones
Ernest Opoku, Richard Tia, Evans Adei
Journal of Molecular Modeling
|
May 24, 2019
Computational studies on [4 + 2] / [3 + 2] tandem sequential cycloaddition reactions of functionalized acetylenes with cyclopentadiene and diazoalkane for the formation of norbornene pyrazolines
Ernest Opoku, Richard Tia, Evans Adei
The Journal of Chemical Physics
|
February 10, 2025
Electron-propagator methods versus experimental ionization energies
Ernest Opoku, Filip Pawłowski, J V Ortiz
Physical Chemistry Chemical Physics : PCCP
|
March 14, 2024
New-generation electron-propagator methods for vertical electron detachment energies of molecular anions: benchmarks and applications to model green-fluorescent-protein chromophores
Ernest Opoku, Filip Pawłowski, J V Ortiz
The Journal of Chemical Physics
|
December 2, 2021
A new generation of diagonal self-energies for the calculation of electron removal energies
Ernest Opoku, Filip Pawłowski, J V Ortiz
The Journal of Physical Chemistry. A
|
August 14, 2024
Electron Binding Energies of Open-Shell Species from Diagonal Electron-Propagator Self-Energies with Unrestricted Hartree-Fock Spin-Orbitals
Ernest Opoku, Filip Pawłowski, J V Ortiz
The Journal of Physical Chemistry. A
|
April 7, 2025
Simplified Ring and Ladder Renormalizations in Electron-Propagator Calculations of Molecular Ionization Energies
Ernest Opoku, Filip Pawłowski, J V Ortiz
The Journal of Physical Chemistry. A
|
February 20, 2024
New-Generation Electron-Propagator Methods for Molecular Electron-Binding Energies
Ernest Opoku, Filip Pawłowski, J V Ortiz
The Journal of Physical Chemistry. A
|
May 30, 2024
<i>Ab Initio</i> Electron Propagators with an Hermitian, Intermediately Normalized Superoperator Metric Applied to Vertical Electron Affinities
Ernest Opoku, Filip Pawłowski, J V Ortiz
Page
of 3