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Localization

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6 results in Keywords: Localization

Energy

Working Paper

Detection, localization, and quantification of single-source methane emissions on oil and gas production sites using point-in-space continuous monitoring systems

William Daniels, Meng Jia, Dorit Hammerling

Version 3 posted 25 September 2023

892

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Theoretical and Computational Chemistry

Working Paper

Exciton localization and transfer in azobenzene aggregates: A surface hopping molecular dynamics study

Evgenii Titov

Version 1 posted 30 March 2023

318

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Theoretical and Computational Chemistry

Working Paper

Eliminating Fragment Group Orbital (eFGO) Analysis for Deciphering Chemical Bonding in Complex Systems

Jing-Xuan Zhang, Fu Kit Sheong, Yun-Shu Cui, Jun Li, Zhenyang Lin

Version 1 posted 13 March 2023

163

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Theoretical and Computational Chemistry

Working Paper

Visible-Light-Induced Exciton Dynamics and Trans-to-Cis Isomerization in Azobenzene Aggregates: Insights from Surface Hopping / Semiempirical Configuration Interaction Molecular Dynamics Simulations

Evgenii Titov

Version 1 posted 04 December 2023

175

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Theoretical and Computational Chemistry

Working Paper

The Role of Double Excitations in Exciton Dynamics of Multiazobenzenes: Trisazobenzenophane as a Test Case

Evgenii Titov

Version 1 posted 30 May 2024

121

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Physical Chemistry

Working Paper

An Accurate and Universal Method for the Anharmonic Vibrational Analysis of the Raman Active C≡C Stretch of Terminal Alkynes

Kristina Streu, Sara Hunsberger, Jeanette Patel, Xiang Wan, Clyde A. Daly Jr.

Version 2 posted 18 October 2023

345

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6 results in Localization in Keywords: Localization

Detection, localization, and quantification of single-source methane emissions on oil and gas production sites using point-in-space continuous monitoring systems

Exciton localization and transfer in azobenzene aggregates: A surface hopping molecular dynamics study

Eliminating Fragment Group Orbital (eFGO) Analysis for Deciphering Chemical Bonding in Complex Systems

Visible-Light-Induced Exciton Dynamics and Trans-to-Cis Isomerization in Azobenzene Aggregates: Insights from Surface Hopping / Semiempirical Configuration Interaction Molecular Dynamics Simulations

The Role of Double Excitations in Exciton Dynamics of Multiazobenzenes: Trisazobenzenophane as a Test Case

An Accurate and Universal Method for the Anharmonic Vibrational Analysis of the Raman Active C≡C Stretch of Terminal Alkynes

6 results in Keywords: Localization