Hrant P Hratchian

23PUBLICATIONS
29CO-AUTHORS
Lasers and quantum electronicsCondensed matter modelling and density functional theorySynchrotronsComputer aided designOrganic semiconductors
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Publications (23)

|Oct 27, 2026
Photodetachment spectra of lanthanide oxide clusters: prevalence and importance of shake-up transitions.

|Jan 12, 2026
Excitation/Relaxation Analysis of Electronic Transitions Using Difference Density Natural Orbitals.

Andrew J Bovill, Ali Abou Taka, Hassan Harb

|Dec 03, 2025
Exploring Anomalous Photoelectron Angular Distributions in the Photoelectron Spectra of Gd3O3-: Study of Gd3O2- and Gd3O3- Using Photoelectron Spectroscopy and Density Functional Theory Calculations.

Caleb D Huizenga, Shivangi Vaish, Christian Dwyer

|Oct 27, 2025
Generalized Internal Coordinates for Creative Exploration of Interatomic Geometries.

Aleksandr V Marenich, Edward N Brothers, Hrant P Hratchian

|May 19, 2025
Quantifying Design Principles for Light-Emitting Materials with Inverted Singlet-Triplet Energy Gaps.

Varun Rishi, Ali Abou Taka, Hrant P Hratchian

|Feb 10, 2025
Photoelectron-remnant interaction effect on remnant wavefunction in low-kinetic energy electron detachment events.

Adam M Kinyua, Hrant P Hratchian, Caroline C Jarrold

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Frequent Collaborators

9 joint publications

Caroline Chick Jarrold

6 joint publications

Ali Abou Taka

4 joint publications

Lee M Thompson

2 joint publications

James C Fettinger