SimTech EXC 2075 Project Network 3 "Data-integrated model reduction for particles and continua"
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tdamp_vs_selfdiff_temp_paramset1_temp1_press1.8.dat
Aug 3, 2022 - Supplementary material for 'Predicting and rationalizing the Soret coefficient of binary Lennard-Jones mixtures in the liquid state'
Fixed Field Text Data - 870 B - MD5: 0afc8fd71e3487d75808a5f6eb938aa5
tdamp_vs_selfdiff_temp_paramset2_temp0.75_press0.09.dat
Aug 3, 2022 - Supplementary material for 'Predicting and rationalizing the Soret coefficient of binary Lennard-Jones mixtures in the liquid state'
Fixed Field Text Data - 879 B - MD5: 5e418608dc5a5592069e35275fafefbc
tdamp_vs_selfdiff_temp_paramset2_temp1_press0.09.dat
Aug 3, 2022 - Supplementary material for 'Predicting and rationalizing the Soret coefficient of binary Lennard-Jones mixtures in the liquid state'
Fixed Field Text Data - 870 B - MD5: bf6f93408a1915e3cc154698eb9bdb6f
tdamp_vs_selfdiff_temp_paramset2_temp1_press1.8.dat
Aug 3, 2022 - Supplementary material for 'Predicting and rationalizing the Soret coefficient of binary Lennard-Jones mixtures in the liquid state'
Fixed Field Text Data - 874 B - MD5: fcd06ee9edd1bd629d8ed0b32523e38a
tdamp_vs_selfdiff_temp_paramset3_temp0.75_press0.09.dat
Aug 3, 2022 - Supplementary material for 'Predicting and rationalizing the Soret coefficient of binary Lennard-Jones mixtures in the liquid state'
Fixed Field Text Data - 875 B - MD5: 92c4eec0198fc3243badecdea2719644
tdamp_vs_selfdiff_temp_paramset3_temp1_press0.09.dat
Aug 3, 2022 - Supplementary material for 'Predicting and rationalizing the Soret coefficient of binary Lennard-Jones mixtures in the liquid state'
Fixed Field Text Data - 864 B - MD5: 791a96b024d7c7b23cf4e3ab93213236
tdamp_vs_selfdiff_temp_paramset3_temp1_press1.8.dat
Aug 3, 2022 - Supplementary material for 'Predicting and rationalizing the Soret coefficient of binary Lennard-Jones mixtures in the liquid state'
Fixed Field Text Data - 872 B - MD5: 616e774522ac1684a45f9f2d121862de
units.py
Aug 3, 2022 - Supplementary material for 'Predicting and rationalizing the Soret coefficient of binary Lennard-Jones mixtures in the liquid state'
Python Source Code - 687 B - MD5: 98837400540ab217f9adea9802d3d29f
vtk.py
Aug 3, 2022 - Supplementary material for 'Predicting and rationalizing the Soret coefficient of binary Lennard-Jones mixtures in the liquid state'
Python Source Code - 9.7 KB - MD5: 909e09dcb3b0c71f7dd3e4fc757ee7b4
ana.py
Jul 20, 2022 - Publication data for: "The presence of a wall enhances the probability for ring-closing metathesis: insights from classical polymer theory and atomistic simulations - data from C6 group"
Python Source Code - 4.0 KB - MD5: 28fccaf3a93f62ff3ac4528afacf4d68
Analysis script to process the trajectories to gather the end to end distance distribution.
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