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List of works by Thomas S Hofer

An effective partial charge model for bulk and surface properties of cubic ZrO2, Y2O3 and yttrium-stabilised zirconia

scientific article published on 13 November 2019

Cu2+ in liquid ammonia-The impact of solvent flexibility and electron correlation in ab initio quantum mechanical charge field molecular dynamics

scientific article published on 31 July 2020

Probing vibrational coupling via a grid-based quantum approach-an efficient strategy for accurate calculations of localized normal modes in solid-state systems

article

Solvation effects on wavenumbers and absorption intensities of the OH-stretch vibration in phenolic compounds - electrical- and mechanical anharmonicity via a combined DFT/Numerov approach

scientific article published on 01 June 2020

Square planar or octahedral after all? The indistinct solvation of platinum(ii)

scientific article published on 29 August 2018

Structure and dynamics of methanol in water: A quantum mechanical charge field molecular dynamics study ⬇️

scientific article published on October 14, 2010

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