Personal information

machine learning, force fields, potential energy surfaces, neural networks

Biography

Researcher of Theoretical Chemistry, with a focus on the use of machine learning to represent chemical potential energy surfaces

Activities

Employment (5)

Leighton: Newcastle, GB

2021-12-13 to present | Senior Software Engineer
Employment
Source: Self-asserted source
Christopher Handley

University of Nottingham: Nottingham, Nottinghamshire, GB

2019-09-16 to 2021-12-13 | Research Software Engineer (School of Computing)
Employment
Source: Self-asserted source
Christopher Handley

University of Sheffield: Sheffield, Sheffield, GB

2015-05-05 to 2019-09-15 | PDRA (Materials Science and Engineering)
Employment
Source: Self-asserted source
Christopher Handley

Ruhr-Universität Bochum: Bochum, Nordrhein-Westfalen, DE

2011-12-19 to 2015-04-31 | PDRA (Theoretical Chemistry)
Employment
Source: Self-asserted source
Christopher Handley

University of Warwick: Coventry, Coventry, GB

2009-01-12 to 2011-12-05 | PDRA (Chemistry)
Employment
Source: Self-asserted source
Christopher Handley

Education and qualifications (2)

University of Manchester: Manchester, Manchester, GB

2005-09 to 2009-01 | PhD Theoretical Chemistry (Chemistry)
Education
Source: Self-asserted source
Christopher Handley

University of Manchester: Manchester, Manchester, GB

2001-09 to 2005-06 | MChem Chemistry with Chemical Physics (Hons) (Chemistry)
Education
Source: Self-asserted source
Christopher Handley

Works (17)

Understanding the structure-dielectric property relationships of (Ba0.8Ca0.2)TiO3-Bi(Mg0.5Ti0.5)O3 perovskites

Acta Materialia
2023-03 | Journal article
Contributors: Christopher M. Handley; Erze Gao; James P. Heath; Derek C. Sinclair; Colin L Freeman
Source: check_circle
Crossref

Dynamic tilting in perovskites

Acta Crystallographica Section A Foundations and Advances
2023-03-01 | Journal article
Contributors: Christopher M. Handley; Robyn E. Ward; Colin L. Freeman; Ian M. Reaney; Derek C. Sinclair; John H. Harding
Source: check_circle
Crossref

A high throughput computational investigation of the solid solution mechanisms of actinides and lanthanides in zirconolite

RSC Advances
2021 | Journal article
Contributors: Stavrina Dimosthenous; Christopher M. Handley; Lewis R. Blackburn; Colin L. Freeman; Neil C. Hyatt
Source: check_circle
Crossref

Stoichiometry-dependent local instability in MAPbI3 perovskite materials and devices

Journal of Materials Chemistry A
2018 | Journal article
Contributors: Vikas Kumar; Jérémy Barbé; Whitney L. Schmidt; Konstantinos Tsevas; Buse Ozkan; Christopher M. Handley; Colin L. Freeman; Derek C. Sinclair; Ian M. Reaney; Wing C. Tsoi et al.
Source: check_circle
Crossref

Phase stability and distortion in high-entropy oxides

Acta Materialia
2018-03 | Journal article
Part of ISSN: 1359-6454
Contributors: G. Anand; Alex P. Wynn; Christopher M. Handley; Colin L. Freeman
Source: Self-asserted source
Christopher Handley via Crossref Metadata Search
grade
Preferred source (of 2)‎

A new potential for methylammonium lead iodide

Physical Chemistry Chemical Physics
2017 | Journal article
Contributors: C. M. Handley; C. L. Freeman
Source: check_circle
Crossref
grade
Preferred source (of 2)‎

Next generation interatomic potentials for condensed systems

European Physical Journal B
2014 | Journal article
EID:

2-s2.0-84929328883

Contributors: Handley, C.M.; Behler, J.
Source: Self-asserted source
Christopher Handley via Scopus - Elsevier

Theoretical Prediction of Spin-Crossover at the Molecular Level

Spin-Crossover Materials: Properties and Applications
2013 | Book
EID:

2-s2.0-84886516955

Contributors: Deeth, R.J.; Handley, C.M.; Houghton, B.J.
Source: Self-asserted source
Christopher Handley via Scopus - Elsevier

Theoretical Prediction of Spin-Crossover at the Molecular Level

2013 | Book
DOI:

10.1002/9781118519301.ch17

ISBN:

9781118519301

Source: Self-asserted source
Christopher Handley via Crossref Metadata Search

Unified approach to multipolar polarisation and charge transfer for ions: microhydrated Na+

Physical Chemistry Chemical Physics
2013 | Journal article
DOI:

10.1039/c3cp53204f

Part of ISSN:

1463-9076;1463-9084

Contributors: Mills, Matthew J. L.; Hawe, Glenn I.; Handley, Christopher M.; Popelier, Paul L. A.
Source: Self-asserted source
Christopher Handley via ResearcherID
grade
Preferred source (of 2)‎

A Multi-Objective Approach to Force Field Optimization: Structures and Spin State Energetics of d(6) Fe(II) Complexes

Journal of Chemical Theory and Computation
2012 | Journal article
Part of ISSN:

1549-9618

Contributors: Handley, Christopher M.; Deeth, Robert J.
Source: Self-asserted source
Christopher Handley via ResearcherID

A Multi-Objective Approach to Force Field Optimization: Structures and Spin State Energetics of d6Fe(II) Complexes

2012 | Journal article
DOI:

10.1021/ct200584a

Part of ISSN:

1549-9618

Source: Self-asserted source
Christopher Handley via Crossref Metadata Search
grade
Preferred source (of 2)‎

Potential Energy Surfaces Fitted by Artificial Neural Networks

2010 | Journal article
DOI:

10.1021/jp9105585

Part of ISSN:

1089-5639

Source: Self-asserted source
Christopher Handley via Crossref Metadata Search
grade
Preferred source (of 3)‎

Dynamically Polarizable Water Potential Based on Multipole Moments Trained by Machine Learning

2009 | Journal article
DOI:

10.1021/ct800468h

Part of ISSN:

1549-9618

Source: Self-asserted source
Christopher Handley via Crossref Metadata Search
grade
Preferred source (of 3)‎

Optimal construction of a fast and accurate polarisable water potential based on multipole moments trained by machine learning

2009 | Journal article
DOI:

10.1039/b905748j

Part of ISSN:

1463-9076

Source: Self-asserted source
Christopher Handley via Crossref Metadata Search
grade
Preferred source (of 3)‎

Beyond Point Charges: Dynamic Polarization from Neural Net Predicted Multipole Moments

2008 | Journal article
DOI:

10.1021/ct800166r

Part of ISSN:

1549-9618

Source: Self-asserted source
Christopher Handley via Crossref Metadata Search
grade
Preferred source (of 3)‎

The Asymptotic Behavior of the Dipole and Quadrupole Moment of a Single Water Molecule from Gas Phase to Large Clusters: A QCT Analysis

2008-05-07 | Journal article | Author
DOI:

10.1080/15533170701854189

Contributors: Christopher Handley
Source: Self-asserted source
Christopher Handley
grade
Preferred source (of 3)‎