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Adam Grofe

Showing results (11-20 of 16) with videos related to

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Journal of Chemical Theory and Computation|December 28, 2020
Generalization of Block-Localized Wave Function for Constrained Optimization of Excited DeterminantsAdam Grofe, Ruoqi Zhao, Andrew Wildman, et al.
The Journal of Physical Chemistry Letters|July 30, 2021
Dynamic-then-Static Approach for Core Excitations of Open-Shell MoleculesRuoqi Zhao, Adam Grofe, Zikuan Wang, et al.
The Journal of Chemical Physics|October 2, 2017
Enhanced vibrational solvatochromism and spectral diffusion by electron rich substituents on small molecule silanesCourtney M Olson, Adam Grofe, Christopher J Huber, et al.
The Journal of Chemical Physics|March 16, 2022
Origin of thiocyanate spectral shifts in water and organic solventsRuoqi Zhao, Joseph C Shirley, Euihyun Lee, et al.
The Journal of Chemical Physics|March 1, 2023
High-throughput ab initio reaction mechanism exploration in the cloud with automated multi-reference validationJan P Unsleber, Hongbin Liu, Leopold Talirz, et al.
The Journal of Chemical Physics|October 21, 2024
Electronic structure simulations in the cloud computing environmentEric J Bylaska, Ajay Panyala, Nicholas P Bauman, et al.
Pageof 2

Showing results (11-20 of 16) with videos related to

Sort By:
Pageof 2
You have reached the last page of results.This site can display upto 16 results.
Journal of Chemical Theory and Computation|December 28, 2020
Generalization of Block-Localized Wave Function for Constrained Optimization of Excited DeterminantsAdam Grofe, Ruoqi Zhao, Andrew Wildman, et al.
The Journal of Physical Chemistry Letters|July 30, 2021
Dynamic-then-Static Approach for Core Excitations of Open-Shell MoleculesRuoqi Zhao, Adam Grofe, Zikuan Wang, et al.
The Journal of Chemical Physics|October 2, 2017
Enhanced vibrational solvatochromism and spectral diffusion by electron rich substituents on small molecule silanesCourtney M Olson, Adam Grofe, Christopher J Huber, et al.
The Journal of Chemical Physics|March 16, 2022
Origin of thiocyanate spectral shifts in water and organic solventsRuoqi Zhao, Joseph C Shirley, Euihyun Lee, et al.
The Journal of Chemical Physics|March 1, 2023
High-throughput ab initio reaction mechanism exploration in the cloud with automated multi-reference validationJan P Unsleber, Hongbin Liu, Leopold Talirz, et al.
The Journal of Chemical Physics|October 21, 2024
Electronic structure simulations in the cloud computing environmentEric J Bylaska, Ajay Panyala, Nicholas P Bauman, et al.
Pageof 2