Nitrogen Hydrate Cage Occupancy and Bulk Modulus Inferred from Density Functional Theory-Derived Cell Parameters
Disciplines :
chemistry, physical
materials science, characterization & testing
materials science, multidisciplinary
Collected date : from 2019 to 2020
Gas clathrate hydrate solid materials, ubiquitous in nature as found either on the ocean floor, permafrost on the Earth, or in extraterrestrial planets and comets, are also technologically relevant, for example, in energy storage or carbon dioxide sequestration. Nitrogen hydrate, in particular, is ...
Lipid model membranes intended for all-atom molecular dynamics
Disciplines :
chemistry, physical
biophysics
Collected date : from 1 Oct 2015 to 30 Sep 2019
Creators :
Timothée Rivel
The data are a series of lipid model membranes designed for the use in all-atoms Molecular dynamics simulations. They are lipid membranes modelling the composition of the lipid matrix of the plasma membrane of eukaryotes with a 5-component model involving phosphatidylcholine (PC), phosphatidylserine ...
