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The Journal of Chemical Physics
|
June 8, 2026
Population transfer in quantum β-Fermi-Pasta-Ulam-Tsingou chains with fixed ends
Jinwen Cai, Xiangyu Xu, Luis Vasquez, et al.
Journal of the American Chemical Society
|
July 30, 2010
Synthesis of the QRSTU domain of maitotoxin and its 85-epi- and 86-epi-diastereoisomers
K C Nicolaou, Christine F Gelin, Jae Hong Seo, et al.
The Journal of Physical Chemistry Letters
|
October 15, 2024
Tracking the Electron Density Changes in Excited States: A Computational Study of Pyrazine
Sebastian V Pios, Jiaji Zhang, Maxim F Gelin, et al.
The Journal of Physical Chemistry Letters
|
January 13, 2022
Ultrafast Internal Conversion Dynamics through the on-the-Fly Simulation of Transient Absorption Pump-Probe Spectra with Different Electronic Structure Methods
Chao Xu, Kunni Lin, Deping Hu, et al.
Journal of Chemical Theory and Computation
|
March 23, 2021
Ab Initio Surface-Hopping Simulation of Femtosecond Transient-Absorption Pump-Probe Signals of Nonadiabatic Excited-State Dynamics Using the Doorway-Window Representation
Maxim F Gelin, Xiang Huang, Weiwei Xie, et al.
Journal of Chemical Theory and Computation
|
July 1, 2026
On-the-Fly Trajectory Simulation of Two-Pulse, Three-Pulse, and Higher-Order Pump-Probe Signals
Mingzhao Bai, Kewei Sun, Luis Vasquez, et al.
The Journal of Physical Chemistry Letters
|
June 13, 2023
Tuning UV Pump X-ray Probe Spectroscopy on the Nitrogen K Edge Reveals the Radiationless Relaxation of Pyrazine: <i>Ab Initio</i> Simulations Using the Quasiclassical Doorway-Window Approximation
Tobias Kaczun, Adrian L Dempwolff, Xiang Huang, et al.
Journal of Chemical Theory and Computation
|
July 16, 2021
Combined Surface-Hopping, Dyson Orbital, and B-Spline Approach for the Computation of Time-Resolved Photoelectron Spectroscopy Signals: The Internal Conversion in Pyrazine
Tomislav Piteša, Marin Sapunar, Aurora Ponzi, et al.
The Journal of Chemical Physics
|
December 29, 2025
Understanding of molecular motions in nonadiabatic photoisomerization dynamics of cis-stilbene with on-the-fly simulation of transient absorption pump-probe spectra
Juanjuan Zhang, Hangxu Liu, Congru Lin, et al.
Journal of Chemical Theory and Computation
|
July 25, 2025
Quasiclassical Doorway-Window Simulation of Femtosecond Transient-Absorption Pump-Probe Signals Beyond the Weak-Pump Limit
Hefen Guan, Kewei Sun, Luis Vasquez, et al.
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of 14
Search research articles
Search
Showing results (111-120 of 140) with videos related to
Sort By:
Page
of 14
The Journal of Chemical Physics
|
June 8, 2026
Population transfer in quantum β-Fermi-Pasta-Ulam-Tsingou chains with fixed ends
Jinwen Cai, Xiangyu Xu, Luis Vasquez, et al.
Journal of the American Chemical Society
|
July 30, 2010
Synthesis of the QRSTU domain of maitotoxin and its 85-epi- and 86-epi-diastereoisomers
K C Nicolaou, Christine F Gelin, Jae Hong Seo, et al.
The Journal of Physical Chemistry Letters
|
October 15, 2024
Tracking the Electron Density Changes in Excited States: A Computational Study of Pyrazine
Sebastian V Pios, Jiaji Zhang, Maxim F Gelin, et al.
The Journal of Physical Chemistry Letters
|
January 13, 2022
Ultrafast Internal Conversion Dynamics through the on-the-Fly Simulation of Transient Absorption Pump-Probe Spectra with Different Electronic Structure Methods
Chao Xu, Kunni Lin, Deping Hu, et al.
Journal of Chemical Theory and Computation
|
March 23, 2021
Ab Initio Surface-Hopping Simulation of Femtosecond Transient-Absorption Pump-Probe Signals of Nonadiabatic Excited-State Dynamics Using the Doorway-Window Representation
Maxim F Gelin, Xiang Huang, Weiwei Xie, et al.
Journal of Chemical Theory and Computation
|
July 1, 2026
On-the-Fly Trajectory Simulation of Two-Pulse, Three-Pulse, and Higher-Order Pump-Probe Signals
Mingzhao Bai, Kewei Sun, Luis Vasquez, et al.
The Journal of Physical Chemistry Letters
|
June 13, 2023
Tuning UV Pump X-ray Probe Spectroscopy on the Nitrogen K Edge Reveals the Radiationless Relaxation of Pyrazine: <i>Ab Initio</i> Simulations Using the Quasiclassical Doorway-Window Approximation
Tobias Kaczun, Adrian L Dempwolff, Xiang Huang, et al.
Journal of Chemical Theory and Computation
|
July 16, 2021
Combined Surface-Hopping, Dyson Orbital, and B-Spline Approach for the Computation of Time-Resolved Photoelectron Spectroscopy Signals: The Internal Conversion in Pyrazine
Tomislav Piteša, Marin Sapunar, Aurora Ponzi, et al.
The Journal of Chemical Physics
|
December 29, 2025
Understanding of molecular motions in nonadiabatic photoisomerization dynamics of cis-stilbene with on-the-fly simulation of transient absorption pump-probe spectra
Juanjuan Zhang, Hangxu Liu, Congru Lin, et al.
Journal of Chemical Theory and Computation
|
July 25, 2025
Quasiclassical Doorway-Window Simulation of Femtosecond Transient-Absorption Pump-Probe Signals Beyond the Weak-Pump Limit
Hefen Guan, Kewei Sun, Luis Vasquez, et al.
Page
of 14