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List of works by Matt I. J. Probert

Anab initiostudy of xenon retention in α-quartz ⬇️

scientific article published on December 10, 2009

Atomistic dynamics of sulfur-deficient high-symmetry grain boundaries in molybdenum disulfide.

scientific article published on 12 July 2017

Atomistic molecular dynamics simulations of shock compressed quartz.

scientific article

DL_MG: A parallel multigrid Poisson and Poisson-Boltzmann solver for electronic structure calculations in vacuum and solution.

scientific article published on 15 February 2018

Exploring atomic defects in molybdenum disulphide monolayers

scientific article

Langevin dynamics in constant pressure extended systems.

scientific article

Many-body renormalization of forces in f -electron materials

scholarly article in Physical Review B, vol. 98 no. 7, August 2018

Materials and Molecular Modeling at the Exascale

scientific article published on 07 January 2022

Nature of the Irreversibility Line in High-Temperature Superconductors

scientific article published on 01 August 1995

Off-the-shelf DFT-DISPersion methods: Are they now "on-trend" for organic molecular crystals?

scientific article published on 01 July 2019

Phase behavior of a three-dimensional core-softened model system

scientific article published on 21 June 2005

Progression of phase behavior for a sequence of model core-softened potentials

scientific article published on 13 December 2005

Quantum Nature of the Proton in Water-Hydroxyl Overlayers on Metal Surfaces

scientific article published in Physical Review Letters

Quantum diffusion of H/D on Ni(111)-A partially adiabatic centroid MD study.

scientific article published in March 2018

The Effect of Cobalt-Sublattice Disorder on Spin Polarisation in Co₂FexMn1-xSi Heusler Alloys

scientific article published on 25 February 2014

Theoretical study of core-loss electron energy-loss spectroscopy at graphene nanoribbon edges.

scientific article

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