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Probing the Electronic Structure of Bulk Water at the Molecular Lengthscale with Angle-Resolved Photoelectron Spectroscopy

Samer Gozem, Robert Seidel, Uwe Hergenhahn, Evgeny Lugovoy, Bernd Abel, Bernd Winter, Anna I. Krylov, Stephen E. Bradforth

Version 2 posted 20 May 2020

920

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Theoretical and Computational Chemistry

Working Paper

The Ionic Atmosphere Effect on the Absorption Spectrum of a Flavoprotein: A Reminder to Consider the Importance of Solution Ions

Benjamin Dratch, Yoelvis Orozco-Gonzalez, Giovanni Gadda, Samer Gozem

Version 1 posted 02 July 2021

329

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Theoretical and Computational Chemistry

Working Paper

OS100: A Benchmark Set of 100 Digitized UV-Visible Spectra and Derived Experimental Oscillator Strengths

Astrid Tarleton, Jorge Garcia-Alvarez, Anah Wynn, Cade Awbrey, Tomas Roberts, Samer Gozem

Version 2 posted 23 December 2021

589

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Chemical Education

Working Paper

Teaching Nonradiative Transitions with MATLAB and Python

Xin Zheng, Matthew C. Drummer, Thomas A. Russell, Samer Gozem, Ksenija D. Glusac

Version 1 posted 21 May 2024

238

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Physical Chemistry

Working Paper

The path to the triplet state in LOV domains

Paulami Ghosh, Stephen O. Ajagbe, Samer Gozem

Version 1 posted 22 October 2024

96

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Theoretical and Computational Chemistry

Working Paper

Electronic Structure Methods for Simulating Flavin’s Spectroscopy and Photophysics: Comparison of Multi-Reference, Single-Reference, and TD-DFT Methods

Mohammad Pabel Kabir, Paulami Ghosh, Samer Gozem

Version 1 posted 06 June 2024

187

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Physical Chemistry

Working Paper

Dipole Effects in the Photoelectron Angular Distributions of the Sulfur Monoxide Anion

Beverly Ru, C. Annie Hart, Richard Mabbs, Samer Gozem, Anna I. Krylov, Andrei Sanov

Version 1 posted 25 July 2022

186

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Physical Chemistry

Working Paper

An Alternative Strategy for Spectral Tuning of Flavin-binding Fluorescent Proteins

Mohammad Pabel Kabir, Daniel Ouedraogo, Yoelvis Orozco-Gonzalez, Giovanni Gadda, Samer Gozem

Version 1 posted 05 September 2022

309

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Physical Chemistry

Working Paper

First and Second Reductions in an Aprotic Solvent: Comparing Computational and Experimental One-electron Reduction Potentials for 345 Quinones

Sarah El Hajj, Samer Gozem

Version 1 posted 08 May 2024

318

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Theoretical and Computational Chemistry

Working Paper

Absorption Intensities of Organic Molecules from Electronic Structure Calculations versus Experiments: The Effect of Solvation, Method, Basis Set, and Transition Moment Gauge

Jorge C. Garcia-Alvarez, Samer Gozem

Version 1 posted 16 May 2024

127

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10 results in Samer Gozem in Authors: Samer Gozem

Probing the Electronic Structure of Bulk Water at the Molecular Lengthscale with Angle-Resolved Photoelectron Spectroscopy

The Ionic Atmosphere Effect on the Absorption Spectrum of a Flavoprotein: A Reminder to Consider the Importance of Solution Ions

OS100: A Benchmark Set of 100 Digitized UV-Visible Spectra and Derived Experimental Oscillator Strengths

Teaching Nonradiative Transitions with MATLAB and Python

The path to the triplet state in LOV domains

Electronic Structure Methods for Simulating Flavin’s Spectroscopy and Photophysics: Comparison of Multi-Reference, Single-Reference, and TD-DFT Methods

Dipole Effects in the Photoelectron Angular Distributions of the Sulfur Monoxide Anion

An Alternative Strategy for Spectral Tuning of Flavin-binding Fluorescent Proteins

First and Second Reductions in an Aprotic Solvent: Comparing Computational and Experimental One-electron Reduction Potentials for 345 Quinones

Absorption Intensities of Organic Molecules from Electronic Structure Calculations versus Experiments: The Effect of Solvation, Method, Basis Set, and Transition Moment Gauge

10 results in Authors: Samer Gozem