Cu_in_bioglass.zip (62.44 MB)
Structural effects of incorporating Cu+ and Cu2+ ions into silicate bioactive glasses using molecular dynamics simulations
dataset
posted on 2023-03-31, 10:29 authored by Jamieson ChristieJamieson Christie, Mitra Soorani, Elisa MeleElisa MeleInput files for simulations of copper-containing bioglass, and analysis files.
The HISTORY files are too large to upload but can be regenerated using the open-source DLPOLY program and the input files given herein.
Funding
EPSRC and MRC Centre for Doctoral Training in Regenerative Medicine
Engineering and Physical Sciences Research Council
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School
- Aeronautical, Automotive, Chemical and Materials Engineering
Department
- Materials