David R. Yarkony

Johns Hopkins University

United States

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Articles (13)

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2024

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2024

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2023

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2023

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2022

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2022

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2022

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2022

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2022

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2021

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2021

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2021

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2021

Collaborators (3)

Hua Guo

Associate/Full/Distinguished Professor

University of New Mexico

UNITED STATES

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Uwe Manthe

Bielefeld University

GERMANY

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Riccardo Conte

Assistant Professor of Theoretical Chemistry

Università degli Studi di Torino

ITALY

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David R. Yarkony

Research Interests

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Contact this professor

Articles (13)

Floquet-Engineered Photodissociation Simulated Using Coupled Potential Energy and Dipole Matrices

The anion photoelectron spectrum and diabatization of tetrazolyl

Toward a Unified Analytical Description of Internal Conversion and Intersystem Crossing in the Photodissociation of Thioformaldehyde. I. Diabatic Singlet States

Quantum Dynamics of Photodissociation: Recent Advances and Challenges

Nonadiabatic Reactive Quenching of OH(A2Σ+) by H2: Origin of High Vibrational Excitation in the H2O Product

Representation of Diabatic Potential Energy Matrices for Multiconfiguration Time-Dependent Hartree Treatments of High-Dimensional Nonadiabatic Photodissociation Dynamics

Permutation invariant polynomial neural network based diabatic ansatz for the (E + A) × (e + a) Jahn–Teller and Pseudo-Jahn–Teller systems

Unified Description of the Jahn–Teller Effect in Molecules with Only Cs Symmetry: Cyclohexoxy in Its Full 48-Dimensional Internal Coordinates

Internal conversion and intersystem crossing dynamics based on coupled potential energy surfaces with full geometry-dependent spin–orbit and derivative couplings. Nonadiabatic photodissociation dynamics of NH3(A) leading to the NH(X3Σ−, a1Δ) + H2 channel

Conical intersection seams in spin–orbit coupled systems with an even number of electrons: A numerical study based on neural network fit surfaces

Full-dimensional quantum stereodynamics of the non-adiabatic quenching of OH(A2Σ+) by H2

Enabling a Unified Description of Both Internal Conversion and Intersystem Crossing in Formaldehyde: A Global Coupled Quasi-Diabatic Hamiltonian for Its S0, S1, and T1 States

Enabling complete multichannel nonadiabatic dynamics: A global representation of the two-channel coupled, 1,21A and 13A states of NH3 using neural networks

Collaborators (3)

Hua Guo

Uwe Manthe

Riccardo Conte

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