Blar i Faculty of Mathematics and Natural Sciences på emneord "Molecular dynamics"
Viser treff 1-3 av 3
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The effect of calcite minerale on hydrate stability and CO2 adsorption
(Master thesis, 2011-06-01)The background for conducting this study are the huge unused possibilities for storage of large quantities of the greenhouse gas carbon dioxide in old or depleted oil reservoirs or deep brackish aquifers. The method of ... -
Fundamental aspects of water methane separation in zeolites
(Master thesis, 2013-06-03)The main objective of this thesis was to use molecular dynamics to investigate the methane interactions with zeolite, specifically the Linde Type A-3A, alongside with an investigation into the use of polynomial path ... -
Molecular Dynamics Study of Selective Adsorption of PCB on Activated Carbon
(Journal article, 2011)The selectivity of PCB adsorption from fish oil onto activated carbon (AC) was investigated by means of molecular dynamics to determine the importance of molecular planarity. PCB congeners 77 and 118 were selected for ...