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Heinen, Matthias; Vrabec, Jadran, 2022, "Coalescence of two nanoscopic argon droplets by molecular dynamics simulation", https://doi.org/10.18419/darus-2434, DaRUS, V1, UNF:6:iT5PmPJDWlYYFAvkmpH6cQ== [fileUNF]
Coalescence of argon droplets with a radius of R=25, 50 and 100 nm was studied with molecular dynamics simulation. The truncated and shifted Lennard-Jones (LJTS) potential was chosen for the intermolecular interactions. Surrounded by coexisting vapor, the droplets were first equi... |
Python Source Code - 2.2 KB -
MD5: 3133376c8f6301379487545e13ca52e1
Simple python script to plot coalescing droplets contours from *.csv files and save them as *.pdf files. Additionally, a sequence of all contours is created by merging the *.pdf files to a single file. |
XZ Archive - 5.6 MB -
MD5: 342db787ddd3727681d73c67459aab8f
Archive containing interface contours of the "early" stages of the droplet coalescence process as *.csv files with fine time resolution. One *.csv file contains the data for a single interface contour described by the spatial coordinates x [nm] and r [nm] at the time instance t [... |
XZ Archive - 10.9 MB -
MD5: 9ef077662d734421b1e48179937752c3
Archive containing interface contours of the "early" stages of the droplet coalescence process as *.csv files with fine time resolution. One *.csv file contains the data for a single interface contour described by the spatial coordinates x [nm] and r [nm] at the time instance t [... |
XZ Archive - 2.8 MB -
MD5: eb7326b90385ee6b223aa8c9a032d1bb
Archive containing interface contours of the "early" stages of the droplet coalescence process as *.csv files with fine time resolution. One *.csv file contains the data for a single interface contour described by the spatial coordinates x [nm] and r [nm] at the time instance t [... |
XZ Archive - 21.0 MB -
MD5: eca188bc9d6a89ae124bca49aa0abed2
Archive containing "full" sequence of droplet coalescence interface contours as *.csv files with coarse time resolution. One *.csv file contains the data for a single interface contour described by the spatial coordinates x [nm] and r [nm] at the time instance t [ps] indicated by... |
XZ Archive - 137.8 MB -
MD5: f9cc6793e5766eff9ca83bd3bba668dc
Archive containing "full" sequence of droplet coalescence interface contours as *.csv files with coarse time resolution. One *.csv file contains the data for a single interface contour described by the spatial coordinates x [nm] and r [nm] at the time instance t [ps] indicated by... |
XZ Archive - 187.1 MB -
MD5: ea2d56948b04d63f65ba78b12734f071
Archive containing "full" sequence of droplet coalescence interface contours as *.csv files with coarse time resolution. One *.csv file contains the data for a single interface contour described by the spatial coordinates x [nm] and r [nm] at the time instance t [ps] indicated by... |
XML - 7.5 KB -
MD5: 7eab970e069b3d03d2d9807a13726a0d
Configuration file used to set parameters for MD simulation with ls1 mardyn, in case of R=100 nm. |
XML - 9.1 KB -
MD5: 91cc0c8c772c7aace8bcd8755abb7ae6
Configuration file used to set parameters for MD simulation with ls1 mardyn, in case of R=25 nm. |
