
Research Associate
Publications
Multidimensional Hydrogen Tunneling in Supported Molecular Switches: The
Role of Surface Interactions
(2020)
Emerging opportunities and future directions: general discussion
– Faraday discussions
(2020)
221,
564
(doi: 10.1039/C9FD90077B)
Zero-point energy and tunnelling: General discussion
– Faraday Discuss
(2020)
221,
478
(doi: 10.1039/C9FD90075F)
Temperature dependence of the vibrational spectrum of porphycene: a qualitative failure of classical-nuclei molecular dynamics
– Faraday Discussions
(2020)
221,
526
(doi: 10.1039/c9fd00056a)
Spectroscopic signatures of quantum effects: general discussion.
– Faraday Discuss
(2020)
221,
322
(doi: 10.1039/C9FD90074H)
Quantum coherence in complex environments: general discussion.
– Faraday Discuss
(2020)
221,
168
(doi: 10.1039/c9fd90076d)
i-PI 2.0: A universal force engine for advanced molecular simulations
– Computer Physics Communications
(2019)
236,
214
(doi: 10.1016/j.cpc.2018.09.020)
Elucidating the Nuclear Quantum Dynamics of Intramolecular Double Hydrogen Transfer in Porphycene.
– J Am Chem Soc
(2019)
141,
2526
(doi: 10.1021/jacs.8b12471)
Elucidating the NuclearQuantum Dynamics of Intramolecular Double
Hydrogen Transfer in Porphycene
(2018)
Photophysics of Xanthene Dyes at High Concentrations in Solid Environments: Charge Transfer Assisted Triplet Formation
– Photochemistry and Photobiology
(2018)
94,
865
(doi: 10.1111/php.12978)
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