Browsing B6 – LU institūti un aģentūras / Institutes and agencies of the UL by Subject "ab initio molecular dynamics"
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Study of High-Temperature Behaviour of ZnO by Ab Initio Molecular Dynamics Simulations and X-ray Absorption Spectroscopy
(MDPI, 2021)D.B., M.K. and A.K. acknowledge access to Piz Daint at the Swiss National Supercomputing Centre, Switzerland (CSCS) under the project ID sm02. The experiment at the MAX IV synchrotron was performed within the project ...