Electronic excited states in deep variational Monte Carlo MT Entwistle, Z Schätzle, PA Erdman, J Hermann, F Noé Nature Communications 14 (1), 274, 2023 | 46 | 2023 |
Local density approximations from finite systems MT Entwistle, MJP Hodgson, J Wetherell, B Longstaff, JD Ramsden, ... Physical Review B 94 (20), 205134, 2016 | 27 | 2016 |
Exact exchange-correlation kernels for optical spectra of model systems MT Entwistle, RW Godby Physical Review B 99 (16), 161102, 2019 | 12 | 2019 |
Comparison of local density functionals based on electron gas and finite systems MT Entwistle, M Casula, RW Godby Physical Review B 97 (23), 235143, 2018 | 8 | 2018 |
Insights from exact exchange-correlation kernels ND Woods, MT Entwistle, RW Godby Physical Review B 103 (12), 125155, 2021 | 7 | 2021 |
Accurate total energies from the adiabatic-connection fluctuation-dissipation theorem ND Woods, MT Entwistle, RW Godby Physical Review B 104 (12), 125126, 2021 | 6 | 2021 |
An improved penalty-based excited-state variational Monte Carlo approach with deep-learning ansatzes PB Szabó, Z Schätzle, MT Entwistle, F Noé Journal of Chemical Theory and Computation 20 (18), 7922-7935, 2024 | 4 | 2024 |
Exact nonadiabatic part of the Kohn-Sham potential and its fluidic approximation MT Entwistle, RW Godby Physical Review Materials 4 (3), 035002, 2020 | 4 | 2020 |
An improved penalty-based excited-state variational Monte Carlo approach with deep-learning ansatzes P Bernát Szabó, Z Schätzle, MT Entwistle, F Noé arXiv e-prints, arXiv: 2405.17089, 2024 | | 2024 |
Data supporting" Accurate Total Energies from the Adiabatic-Connection Fluctuation-Dissipation Theorem" N Woods, R Godby, M Entwistle | | 2021 |
Data supporting" Insights from exact exchange-correlation kernels" N Woods, R Godby, M Entwistle | | 2021 |
Characterising and approximating exact density functionals for model electronic systems M Entwistle University of York, 2020 | | 2020 |
Exact exchange-correlation kernels for optical spectra M Entwistle, R Godby APS March Meeting Abstracts 2019, E20. 002, 2019 | | 2019 |
Steps in the Exact Kohn-Sham Potential of Ensemble Density-functional Theory for Excited States and Their Relation to the Derivative Discontinuity M Hodgson, E Kraisler, M Entwistle, A Schild, EK Gross APS March Meeting Abstracts 2018, P02. 004, 2018 | | 2018 |
This is a repository copy of Local density approximations from finite systems. M Entwistle, M Hodgson, J Wetherell | | |
A comparison of novel and conventional local density functionals MT Entwistle, M Casula, RW Godby | | |