Thomas J. Penfold

United Kingdom

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Articles (21)

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2024

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2023

Collaborators (14)

Christopher Groves

Prof

University of Durham

UNITED KINGDOM

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Basile Curchod

Associate Professor

University of Bristol

UNITED KINGDOM

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Bogdan MAREKHA

Assistant professor

FRANCE

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Philippe C. Gros

Université de Lorraine

FRANCE

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Robert Pal

Professor of Physical Chemistry

University of Durham

UNITED KINGDOM

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Lewis Edward MacKenzie

University Of Strathclyde

UNITED KINGDOM

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Stefan Haacke

Full Professor

University of Strasbourg

FRANCE

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Noel Healy

Prof at Newcastle University

Newcastle University

UNITED KINGDOM

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Alison Walker

University of Bath

UNITED KINGDOM

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Philippe Wernet

Uppsala University

SWEDEN

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Elisabetta Arca

Senior Lecturer in Experimental Physics

Newcastle University

UNITED KINGDOM

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Matthew J. Wolf

RWTH Aachen University

GERMANY

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J. Olof Johansson

University of Edinburgh

UNITED KINGDOM

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Marina Freitag

Newcastle University

UNITED KINGDOM

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Thomas J. Penfold

Research Interests

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Articles (21)

Exploring the Influence of Approximations for Simulating Valence Excited X-ray Spectra

Towards the accurate simulation of multi-resonance emitters using mixed-reference spin-flip time-dependent density functional theory

Rigid and planar π-conjugated molecules leading to long-lived intramolecular charge-transfer states exhibiting thermally activated delayed fluorescence

Conformational Control of Donor–Acceptor Molecules Using Non-covalent Interactions

Mechanochemical Polyoxometalate Super-Reduction with Lithium Metal

Web-CONEXS: an inroad to theoretical X-ray absorption spectroscopy

Machine-learning strategies for the accurate and efficient analysis of x-ray spectroscopy

Tracking nuclear motion in single-molecule magnets using femtosecond X-ray absorption spectroscopy

The photochemistry of Rydberg-excited cyclobutanone: Photoinduced processes and ground state dynamics

Spin-Vibronic Intersystem Crossing and Molecular Packing Effects in Heavy Atom Free Organic Phosphor

Ionic Accumulation as a Diagnostic Tool in Perovskite Solar Cells: Characterizing Band Alignment with Rapid Voltage Pulses

Synthesis and Structural Diversification of Circularly Polarised Luminescence Active, Helically Chiral, “Confused” N,N,O,C‐BODIPYs**

Towards panchromatic Fe(ii) NHC sensitizers via HOMO inversion

Modelling the effect of dipole ordering on charge-carrier mobility in organic semiconductors

A Δ-learning strategy for interpretation of spectroscopic observables

Towards understanding and controlling ultrafast dynamics in molecular photomagnets

A deep neural network for valence-to-core X-ray emission spectroscopy

Tailoring Donor‐Acceptor Emitters to Minimise Localisation Induced Quenching of Thermally Activated Delayed Fluorescence

An on-the-fly deep neural network for simulating time-resolved spectroscopy: predicting the ultrafast ring opening dynamics of 1,2-dithiane

Mind the GAP: quantifying the breakdown of the linear vibronic coupling Hamiltonian

Towards the automated extraction of structural information from X-ray absorption spectra

Collaborators (14)

Christopher Groves

Basile Curchod

Bogdan MAREKHA

Philippe C. Gros

Robert Pal

Lewis Edward MacKenzie

Stefan Haacke

Noel Healy

Alison Walker

Philippe Wernet

Elisabetta Arca

Matthew J. Wolf

J. Olof Johansson

Marina Freitag

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