Search research articles
Contact Us
Filters
Showing results (1-10 of 13) with videos related to
Page
of 2
Sort By:
The Journal of Physical Chemistry Letters
|
December 4, 2023
Ground-State Orbital Analysis Predicts S<sub>1</sub> Charge Transfer in Donor-Acceptor Materials
Ali Abou Taka, John M Herbert, Laura M McCaslin
Journal of Chemical Theory and Computation
|
January 12, 2026
Excitation/Relaxation Analysis of Electronic Transitions Using Difference Density Natural Orbitals
Andrew J Bovill, Ali Abou Taka, Hassan Harb, et al.
The Journal of Physical Chemistry Letters
|
May 19, 2025
Quantifying Design Principles for Light-Emitting Materials with Inverted Singlet-Triplet Energy Gaps
Varun Rishi, Ali Abou Taka, Hrant P Hratchian, et al.
Journal of Computational Chemistry
|
December 22, 2021
Using projection operators with maximum overlap methods to simplify challenging self-consistent field optimization
Hector H Corzo, Ali Abou Taka, Aurora Pribram-Jones, et al.
Journal of Chemical Theory and Computation
|
November 29, 2022
Good Vibrations: Calculating Excited-State Frequencies Using Ground-State Self-Consistent Field Models
Ali Abou Taka, Hector H Corzo, Aurora Pribram Jones, et al.
The Journal of Chemical Physics
|
December 31, 2020
Unveiling the coexistence of cis- and trans-isomers in the hydrolysis of ZrO<sub>2</sub>: A coupled DFT and high-resolution photoelectron spectroscopy study
Ali Abou Taka, Mark C Babin, Xianghai Sheng, et al.
The Journal of Chemical Physics
|
June 17, 2018
High-resolution photoelectron spectroscopy of TiO<sub>3</sub>H<sub>2</sub><sup>-</sup>: Probing the TiO<sub>2</sub><sup>-</sup> + H<sub>2</sub>O dissociative adduct
Jessalyn A DeVine, Ali Abou Taka, Mark C Babin, et al.
The Journal of Physical Chemistry. A
|
November 3, 2021
New Photoelectron-Valence Electron Interactions Evident in the Photoelectron Spectrum of Gd<sub>2</sub>O<sup></sup>
Jarrett L Mason, Hassan Harb, Ali Abou Taka, et al.
Journal of the American Chemical Society
|
April 30, 2024
Site-Specific Photochemistry along a Protonated Peptide Scaffold
Casey D Foley, Chin Lee, Ali Abou Taka, et al.
The Journal of Physical Chemistry. A
|
January 19, 2021
Photoelectron Spectra of Gd<sub>2</sub>O<sub>2</sub><sup>-</sup> and Nonmonotonic Photon-Energy-Dependent Variations in Populations of Close-Lying Neutral States
Jarrett L Mason, Hassan Harb, Ali Abou Taka, et al.
Page
of 2
Search research articles
Search
Showing results (1-10 of 13) with videos related to
Sort By:
Page
of 2
The Journal of Physical Chemistry Letters
|
December 4, 2023
Ground-State Orbital Analysis Predicts S<sub>1</sub> Charge Transfer in Donor-Acceptor Materials
Ali Abou Taka, John M Herbert, Laura M McCaslin
Journal of Chemical Theory and Computation
|
January 12, 2026
Excitation/Relaxation Analysis of Electronic Transitions Using Difference Density Natural Orbitals
Andrew J Bovill, Ali Abou Taka, Hassan Harb, et al.
The Journal of Physical Chemistry Letters
|
May 19, 2025
Quantifying Design Principles for Light-Emitting Materials with Inverted Singlet-Triplet Energy Gaps
Varun Rishi, Ali Abou Taka, Hrant P Hratchian, et al.
Journal of Computational Chemistry
|
December 22, 2021
Using projection operators with maximum overlap methods to simplify challenging self-consistent field optimization
Hector H Corzo, Ali Abou Taka, Aurora Pribram-Jones, et al.
Journal of Chemical Theory and Computation
|
November 29, 2022
Good Vibrations: Calculating Excited-State Frequencies Using Ground-State Self-Consistent Field Models
Ali Abou Taka, Hector H Corzo, Aurora Pribram Jones, et al.
The Journal of Chemical Physics
|
December 31, 2020
Unveiling the coexistence of cis- and trans-isomers in the hydrolysis of ZrO<sub>2</sub>: A coupled DFT and high-resolution photoelectron spectroscopy study
Ali Abou Taka, Mark C Babin, Xianghai Sheng, et al.
The Journal of Chemical Physics
|
June 17, 2018
High-resolution photoelectron spectroscopy of TiO<sub>3</sub>H<sub>2</sub><sup>-</sup>: Probing the TiO<sub>2</sub><sup>-</sup> + H<sub>2</sub>O dissociative adduct
Jessalyn A DeVine, Ali Abou Taka, Mark C Babin, et al.
The Journal of Physical Chemistry. A
|
November 3, 2021
New Photoelectron-Valence Electron Interactions Evident in the Photoelectron Spectrum of Gd<sub>2</sub>O<sup></sup>
Jarrett L Mason, Hassan Harb, Ali Abou Taka, et al.
Journal of the American Chemical Society
|
April 30, 2024
Site-Specific Photochemistry along a Protonated Peptide Scaffold
Casey D Foley, Chin Lee, Ali Abou Taka, et al.
The Journal of Physical Chemistry. A
|
January 19, 2021
Photoelectron Spectra of Gd<sub>2</sub>O<sub>2</sub><sup>-</sup> and Nonmonotonic Photon-Energy-Dependent Variations in Populations of Close-Lying Neutral States
Jarrett L Mason, Hassan Harb, Ali Abou Taka, et al.
Page
of 2