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Jacek Jakowski

Showing results (11-20 of 32) with videos related to

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Journal of Chemical Theory and Computation|August 10, 2016
Understanding How Isotopes Affect Charge Transfer in P3HT/PCBM: A Quantum Trajectory-Electronic Structure Study with Nonlinear Quantum CorrectionsLei Wang, Jacek Jakowski, Sophya Garashchuk, et al.
Journal of Chemical Theory and Computation|January 4, 2020
Understanding Beam-Induced Electronic Excitations in MaterialsDavid B Lingerfelt, Panchapakesan Ganesh, Jacek Jakowski, et al.
The Journal of Physical Chemistry. B|October 6, 2023
Quantum Chemical Simulations of CO<sub>2</sub> and N<sub>2</sub> Capture in Reline, a Prototypical Deep Eutectic SolventJacek Jakowski, Jingsong Huang, Syed Z Islam, et al.
Journal of Computational Chemistry|December 15, 2018
A fast scheme to calculate electronic couplings between P3HT polymer units using diabatic orbitals for charge transfer dynamics simulationsTao Yu, Florence Fabunmi, Jingsong Huang, et al.
Journal of Chemical Theory and Computation|November 14, 2022
Extracting Inelastic Scattering Cross Sections for Finite and Aperiodic Materials from Electronic Dynamics SimulationsDavid B Lingerfelt, Anthony Yoshimura, Jacek Jakowski, et al.
Nanoscale Research Letters|March 27, 2012
Detection of hydrogen using grapheneRobert C Ehemann, Predrag S Krstić, Jonny Dadras, et al.
The Journal of Physical Chemistry. A|January 4, 2021
Electron-Beam-Induced Molecular Plasmon Excitation and Energy Transfer in Silver Molecular NanowiresTao Yu, David Lingerfelt, Jacek Jakowski, et al.
Nano Letters|December 18, 2020
Nonadiabatic Effects on Defect Diffusion in Silicon-Doped NanographenesDavid B Lingerfelt, Tao Yu, Anthony Yoshimura, et al.
Journal of Chemical Theory and Computation|January 23, 2025
Simulation of 24,000 Electron Dynamics: Real-Time Time-Dependent Density Functional Theory (TDDFT) with the Real-Space Multigrids (RMG)Jacek Jakowski, Wenchang Lu, Emil Briggs, et al.
The Journal of Physical Chemistry Letters|August 26, 2017
Deuteration as a Means to Tune Crystallinity of Conducting PolymersJacek Jakowski, Jingsong Huang, Sophya Garashchuk, et al.
Pageof 4

Showing results (11-20 of 32) with videos related to

Sort By:
Pageof 4
Journal of Chemical Theory and Computation|August 10, 2016
Understanding How Isotopes Affect Charge Transfer in P3HT/PCBM: A Quantum Trajectory-Electronic Structure Study with Nonlinear Quantum CorrectionsLei Wang, Jacek Jakowski, Sophya Garashchuk, et al.
Journal of Chemical Theory and Computation|January 4, 2020
Understanding Beam-Induced Electronic Excitations in MaterialsDavid B Lingerfelt, Panchapakesan Ganesh, Jacek Jakowski, et al.
The Journal of Physical Chemistry. B|October 6, 2023
Quantum Chemical Simulations of CO<sub>2</sub> and N<sub>2</sub> Capture in Reline, a Prototypical Deep Eutectic SolventJacek Jakowski, Jingsong Huang, Syed Z Islam, et al.
Journal of Computational Chemistry|December 15, 2018
A fast scheme to calculate electronic couplings between P3HT polymer units using diabatic orbitals for charge transfer dynamics simulationsTao Yu, Florence Fabunmi, Jingsong Huang, et al.
Journal of Chemical Theory and Computation|November 14, 2022
Extracting Inelastic Scattering Cross Sections for Finite and Aperiodic Materials from Electronic Dynamics SimulationsDavid B Lingerfelt, Anthony Yoshimura, Jacek Jakowski, et al.
Nanoscale Research Letters|March 27, 2012
Detection of hydrogen using grapheneRobert C Ehemann, Predrag S Krstić, Jonny Dadras, et al.
The Journal of Physical Chemistry. A|January 4, 2021
Electron-Beam-Induced Molecular Plasmon Excitation and Energy Transfer in Silver Molecular NanowiresTao Yu, David Lingerfelt, Jacek Jakowski, et al.
Nano Letters|December 18, 2020
Nonadiabatic Effects on Defect Diffusion in Silicon-Doped NanographenesDavid B Lingerfelt, Tao Yu, Anthony Yoshimura, et al.
Journal of Chemical Theory and Computation|January 23, 2025
Simulation of 24,000 Electron Dynamics: Real-Time Time-Dependent Density Functional Theory (TDDFT) with the Real-Space Multigrids (RMG)Jacek Jakowski, Wenchang Lu, Emil Briggs, et al.
The Journal of Physical Chemistry Letters|August 26, 2017
Deuteration as a Means to Tune Crystallinity of Conducting PolymersJacek Jakowski, Jingsong Huang, Sophya Garashchuk, et al.
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