Data for "Second Critical Point in Two Realistic Models of Water"
- 1. Department of Chemical and Biological Engineering, Princeton University
- 2. Department of Physics, Sapienza, University of Rome.
Description
Data associated to the publication "Second Critical Point in Two Realistic Models of Water" to appear in Science in 2020.
e-rho-2005.tgz files with potential energy and density for the model TIP4P-2005 (N=300,500,1000)
e-rho-tip4pice.tgz files with potential energy and density for the model TIP4P-Ice (N=300,500,1000)
sk-dat.tgz files with the structure factor for TIP4P-2005 (N=36424) and TIP4P-Ice (N=10000)
mdp-gro-top-2005.tgz input files for all studied state point in GROMACS format for TIP4P-2005 (mdp, gro, top) (N=300,500,1000)
mdp-gro-top-Ice.tgz input files for all studied state point in GROMACS format for TIP4P-Ice (mdp, gro, top) (N=300,500,1000)
large-systems.tgz input files for all studied state point in GROMACS format for TIP4P-Ice (N=10000) and TIP4P-2005 (N=36424)
Files
Files
(1.2 GB)
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md5:ba004733fd1f559b44baf95adbd3d6a8
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925.4 MB | Download |
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md5:4c7ff8e018eea8d327b7349bca284613
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212.7 MB | Download |
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md5:45c910676c43febbd4f5b744b2d6927b
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58.0 MB | Download |
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md5:3a1e8785335933c871c69c8cc84fd37b
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9.0 MB | Download |
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md5:6e1b051553a58ddc6b5df5f3b3818677
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11.5 MB | Download |
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md5:712235e4aa3914e8f6e52ba55e55648c
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15.8 kB | Download |