David M. G. Williams - Dissemin

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All papers authored by David M. G. Williams

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2023 David M. G. Williams

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, Eirik F. Kjønstad

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, Todd J. Martínez

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Geometric phase in coupled cluster theory

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2022 David M. G. Williams

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, Wolfgang Eisfeld

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, Alexandra Viel

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Simulation of the photodetachment spectra of the nitrate anion (NO₃⁻) in the B̃ ²E′ energy range and non-adiabatic electronic population dynamics of NO₃

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2021 Alexandra Viel

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, David M. G. Williams

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, Wolfgang Eisfeld

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Accurate quantum dynamics simulation of the photodetachment spectrum of the nitrate anion (NO3−) based on an artificial neural network diabatic potential model

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2020 David Mounir Günter Williams

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, Wolfgang Eisfeld

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Complete Nuclear Permutation Inversion Invariant Artificial Neural Network (CNPI-ANN) Diabatization for the Accurate Treatment of Vibronic Coupling Problems

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2019 David M. G. Williams

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, Alexandra Viel

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, Wolfgang Eisfeld

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Diabatic neural network potentials for accurate vibronic quantum dynamics—The test case of planar NO3

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Thomas Weike

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, David M. G. Williams

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, Alexandra Viel, Wolfgang Eisfeld

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Quantum dynamics and geometric phase in E ⊗ e Jahn-Teller systems with general Cnv symmetry

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2018 David M. G. Williams

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, Wolfgang Eisfeld

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Neural network diabatization: A new ansatz for accurate high-dimensional coupled potential energy surfaces

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2016 Nils Wittenbrink, Florian Venghaus, David Williams

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, Wolfgang Eisfeld

A new approach for the development of diabatic potential energy surfaces: Hybrid block-diagonalization and diabatization by ansatz

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