David E Manolopoulos

Scopus Author ID ORCID

Publication Activity (10 Years)

Years Active: 2018-2024
Publications (10 Years): 16

Top Venues

The Journal of chemical physics

Physical chemistry chemical physics : PCCP

University of Oxford

This page only lists publications with an associated author ORCID identifier.

Affiliation History

University of Oxford Sep 01 1995

United Kingdom

Professor of Theoretical Chemistry :: Chemistry

Publications

Johan E Runeson, Thomas P Fay, David E Manolopoulos
Exciton dynamics from the mapping approach to surface hopping: comparison with Förster and Redfield theories. Physical chemistry chemical physics : PCCP 26 (6) (2024)
Johan E Runeson, Thomas P Fay, David E Manolopoulos
Exciton dynamics from the mapping approach to surface hopping: comparison with Förster and Redfield theories. Physical chemistry chemical physics : PCCP (2024)
Johan E Runeson, Thomas P Fay, David E Manolopoulos
Exciton dynamics from the mapping approach to surface hopping: comparison with Förster and Redfield theories. Physical chemistry chemical physics : PCCP 26 (6) (2024)
Michele Ceriotti, Lasse Jensen, David E Manolopoulos, Todd J Martinez, David R Reichman, Francesco Sciortino, C David Sherrill, Qiang Shi, Carlos Vega, Lai-Sheng Wang, Emily Allyn Weiss, Xiaoyang Zhu, Jennifer L Stein, Tianquan Lian
2021 JCP Emerging Investigator Special Collection. The Journal of chemical physics 158 (6) (2023)
Annina Z Lieberherr, Seth T E Furniss, Joseph E Lawrence, David E Manolopoulos
Vibrational strong coupling in liquid water from cavity molecular dynamics. The Journal of chemical physics 158 (23) (2023)
Michele Ceriotti, Lasse Jensen, David E Manolopoulos, Todd J Martinez, Angelos Michaelides, Jennifer P Ogilvie, David R Reichman, Qiang Shi, John E Straub, Carlos Vega, Lai-Sheng Wang, Emily Allyn Weiss, Xiaoyang Zhu, Jennifer L Stein, Tianquan Lian
2020 JCP Emerging Investigator Special Collection. The Journal of chemical physics 155 (23) (2022)
Filippo Bigi, Kevin K Huguenin-Dumittan, Michele Ceriotti, David E Manolopoulos
A smooth basis for atomistic machine learning. The Journal of chemical physics 157 (23) (2022)
C David Sherrill, David E Manolopoulos, Todd J Martinez, Michele Ceriotti, Angelos Michaelides
Chemical physics software. The Journal of chemical physics 155 (1) (2021)
Mark D Ediger, Lasse Jensen, David E Manolopoulos, Todd J Martinez, Angelos Michaelides, David R Reichman, C David Sherrill, Qiang Shi, John E Straub, Carlos Vega, Lai-Sheng Wang, Erinn C Brigham, Tianquan Lian
JCP Emerging Investigator Special Collection 2019. The Journal of chemical physics 153 (11) (2021)
Lachlan P Lindoy, Thomas P Fay, David E Manolopoulos
Quantum mechanical spin dynamics of a molecular magnetoreceptor. The Journal of chemical physics 152 (16) (2020)
Joseph E Lawrence, David E Manolopoulos
An analysis of isomorphic RPMD in the golden rule limit. The Journal of chemical physics 151 (24) (2020)
C David Sherrill, David E Manolopoulos, Todd J Martinez, Angelos Michaelides
Electronic structure software. The Journal of chemical physics 153 (7) (2020)
Thomas P Fay, Lachlan P Lindoy, David E Manolopoulos
Electron spin relaxation in radical pairs: Beyond the Redfield approximation. The Journal of chemical physics 151 (15) (2019)
Joseph E Lawrence, Theo Fletcher, Lachlan P Lindoy, David E Manolopoulos
On the calculation of quantum mechanical electron transfer rates. The Journal of chemical physics 151 (11) (2019)
Alan M Lewis, Thomas P Fay, David E Manolopoulos, Christian Kerpal, Sabine Richert, Christiane R Timmel
On the low magnetic field effect in radical pair reactions. The Journal of chemical physics 149 (3) (2018)
Thomas P Fay, Lachlan P Lindoy, David E Manolopoulos
Spin-selective electron transfer reactions of radical pairs: Beyond the Haberkorn master equation. The Journal of chemical physics 149 (6) (2018)

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Publication Activity (10 Years)

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David E Manolopoulos