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List of works by David B Lingerfelt

"Watching" Polaron Pair Formation from First-Principles Electron-Nuclear Dynamics.

scientific article published on 29 August 2016

Ab Initio Excited-State Transient Raman Analysis.

scientific article

Ab Initio Transient Vibrational Spectral Analysis

scientific article published on 31 October 2016

Ab initio two-component Ehrenfest dynamics.

scientific article published in September 2015

Anisotropic Polarizability-Induced Plasmon Transfer

Can Excited State Electronic Coherence Be Tuned via Molecular Structural Modification? A First-Principles Quantum Electronic Dynamics Study of Pyrazolate-Bridged Pt(II) Dimers.

scientific article published on 16 February 2017

Can Quantized Vibrational Effects Be Obtained from Ehrenfest Mixed Quantum-Classical Dynamics?

scientific article

Coupling Real-Time Time-Dependent Density Functional Theory with Polarizable Force Field

scientific article published on 10 October 2017

Direct ab Initio (Meta-)Surface-Hopping Dynamics

scientific article published on 8 February 2016

Electron-Beam-Induced Molecular Plasmon Excitation and Energy Transfer in Silver Molecular Nanowires

scientific article published on 02 January 2021

Excited State Molecular Dynamics: Beyond the Born-Oppenheimer Approximation ⬇️

doctoral dissertation by David B Lingerfelt, Chemistry, University of Washington, 2017

From charge-transfer to a charge-separated state: a perspective from the real-time TDDFT excitonic dynamics.

scientific article

Molecular Vibration Induced Plasmon Decay

article

Non-adiabatic molecular dynamics investigation of photoionization state formation and lifetime in Mn²⁺-doped ZnO quantum dots.

scientific article

Nonadiabatic Effects on Defect Diffusion in Silicon-Doped Nanographenes

scientific article published on 18 December 2020

Role of Vibrational Dynamics on Excited-State Electronic Coherence in a Binuclear Platinum Complex.

scientific article published on 13 April 2018

Strain-Induced asymmetry and on-site dynamics of silicon defects in graphene

scientific article published in 2022

The Role of Excited-State Proton Relays in the Photochemical Dynamics of Water Nanodroplets

scientific article published on 20 June 2019

Time-dependent non-equilibrium dielectric response in QM/continuum approaches

scientific article published in January 2015

Toward Electrochemical Studies on the Nanometer and Atomic Scales: Progress, Challenges, and Opportunities

scientific article published on 16 September 2019

Ultrafast Nonradiative Decay of a Dipolar Plasmon-like State in Naphthalene

scientific article published on 12 November 2020

Understanding Beam-Induced Electronic Excitations in Materials

scientific article published on 17 January 2020

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