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List of works by David B Williams-Young

A Shift Selection Strategy for Parallel Shift-invert Spectrum Slicing in Symmetric Self-consistent Eigenvalue Computation

scientific article published on 16 October 2020

A Well-Tempered Hybrid Method for Solving Challenging Time-Dependent Density Functional Theory (TDDFT) Systems

scientific article published on 23 March 2018

Ab Initio Excited-State Transient Raman Analysis.

scientific article

Ab Initio Transient Vibrational Spectral Analysis

scientific article published on 31 October 2016

Accelerating Real-Time Time-Dependent Density Functional Theory with a Nonrecursive Chebyshev Expansion of the Quantum Propagator

scientific article published on 17 October 2016

Accurate Assignments of Excited-State Resonance Raman Spectra: A Benchmark Study Combining Experiment and Theory.

scientific article published on 27 September 2017

An ab Initio Linear Response Method for Computing Magnetic Circular Dichroism Spectra with Nonperturbative Treatment of Magnetic Field

scientific article published on 12 April 2019

Approximate Green's Function Coupled Cluster Method Employing Effective Dimension Reduction

scientific article published on 16 April 2019

Direct ab Initio (Meta-)Surface-Hopping Dynamics

scientific article published on 8 February 2016

Effective Inclusion of Mechanical and Electrical Anharmonicity in Excited Electronic States: VPT2-TDDFT Route.

scientific article published on 28 April 2017

Efficient Implementation of Variation after Projection Generalized Hartree-Fock.

scientific article

Generalized Hartree-Fock with Nonperturbative Treatment of Strong Magnetic Fields: Application to Molecular Spin Phase Transitions

scientific article published on 13 December 2018

Model Order Reduction Algorithm for Estimating the Absorption Spectrum.

scientific article

Relativistic Real-Time Time-Dependent Equation-of-Motion Coupled-Cluster

scientific article published on 05 November 2019

Relativistic Two-Component Particle-Particle Tamm-Dancoff Approximation.

scientific article published on 26 September 2016

Simulating Magnetic Circular Dichroism Spectra with Real-Time Time-Dependent Density Functional Theory in Gauge Including Atomic Orbitals

scientific article published on 07 November 2019

The Effect of Geometry, Spin, and Orbital Optimization in Achieving Accurate, Correlated Results for Iron–Sulfur Cubanes

scientific article published on 16 January 2022

Towards Efficient and Scalable Electronic Structure Methods for the Treatment of Relativistic Effects and Molecular Response ⬇️

doctoral dissertation by David Williams-Young, Chemistry, University of Washington, 2018

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