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Supporting Information: Chemical Potential Differences in Nanoscopic Teflon/Kapton Capillaries
Jun 6, 2024 - PN 1-8
Stärk, Philipp; Schlaich, Alexander, 2024, "Supporting Information: Chemical Potential Differences in Nanoscopic Teflon/Kapton Capillaries", https://doi.org/10.18419/darus-3149, DaRUS, V1
This is the repository holding the supporting information for atomistic Molecular Dynamics Simulations of Teflon/Kapton capillaries. Here we list the simulation input scripts as well as analysis scripts. See the README file for more information.
README.md
Jun 6, 2024 - Supporting Information: Chemical Potential Differences in Nanoscopic Teflon/Kapton Capillaries
Markdown Text - 860 B - MD5: 2418a6892455724bf14e4f90da464c50
condor_basis.sub
Jun 6, 2024 - Supporting Information: Chemical Potential Differences in Nanoscopic Teflon/Kapton Capillaries
text/vnd.dvb.subtitle - 23 B - MD5: 1c0fdb9691438fa2ba94a7da18c69782
entire_index.ndx
Jun 6, 2024 - Supporting Information: Chemical Potential Differences in Nanoscopic Teflon/Kapton Capillaries
Unknown - 438.1 KB - MD5: 17e7c8da4507b9497e1ce34e68fd86cf
entire_index_h3o.ndx
Jun 6, 2024 - Supporting Information: Chemical Potential Differences in Nanoscopic Teflon/Kapton Capillaries
Unknown - 438.1 KB - MD5: 68255f43c632da2b145e55f1f6721040
equilibration.mdp
Jun 6, 2024 - Supporting Information: Chemical Potential Differences in Nanoscopic Teflon/Kapton Capillaries
Unknown - 705 B - MD5: fbdb769c816ee0d425c44a47c4f5ad09
generate_runs.py
Jun 6, 2024 - Supporting Information: Chemical Potential Differences in Nanoscopic Teflon/Kapton Capillaries
Python Source Code - 8.1 KB - MD5: 35ce4253ef5226a7b00e1e05c63f457c
hydroxide.itp
Jun 6, 2024 - Supporting Information: Chemical Potential Differences in Nanoscopic Teflon/Kapton Capillaries
application/vnd.shana.informed.formtemplate - 490 B - MD5: 3c6151df8787cde07c839be25a23d003
ions.itp
Jun 6, 2024 - Supporting Information: Chemical Potential Differences in Nanoscopic Teflon/Kapton Capillaries
application/vnd.shana.informed.formtemplate - 544 B - MD5: 48762cb26463305115cfe1fa27f18b98
kapton.itp
Jun 6, 2024 - Supporting Information: Chemical Potential Differences in Nanoscopic Teflon/Kapton Capillaries
application/vnd.shana.informed.formtemplate - 15.6 KB - MD5: 78e5db9993842527bfe5bc20d3b429bc
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