Dataverse concerning Molecular simulation studies.
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Hierarchical Data Format - 16.9 KB - MD5: 6e7b227719170ae356cf33882bc3edc2
Center of mass density profiles of hexane from a simulation of an rectangular box with pure hexane simulated at 295K in HDF5 format.
Hierarchical Data Format - 878.7 KB - MD5: ff3aa6fd18e8d1bfeee8299f353999e9
Diffusion profile of the center of mass of hexane along the simulation box determined using the Smoluchowski method from a simulation of a rectangular box with pure hexane simulated at 295K in HDF5 format.
Hierarchical Data Format - 16.9 KB - MD5: 4c43e2ec7c5025ebb9ae02a43b4cbb8b
Center of mass density profiles of methanol from a simulation of an rectangular box with pure methanol simulated at 295K in HDF5 format.
Hierarchical Data Format - 878.7 KB - MD5: c67da0d7c1e67400efbbf6126883921d
Diffusion profile of the center of mass of methanol along the simulation box determined using the Smoluchowski method from a simulation of a rectangular box with pure methanol simulated at 295K in HDF5 format.
Hierarchical Data Format - 16.9 KB - MD5: 4dc9a062760302bc83d6664b73ef22ad
Center of mass density profiles of pyridine from a simulation of an rectangular box with pure pyridine simulated at 295K in HDF5 format.
Hierarchical Data Format - 878.7 KB - MD5: dec34032088096d16a08a93f44d2e7cb
Diffusion profile of the center of mass of pyridine along the simulation box determined using the Smoluchowski method from a simulation of a rectangular box with pure pyridine simulated at 295K in HDF5 format.
Hierarchical Data Format - 16.9 KB - MD5: 237b42d95612d75cfb1bad1404384ffc
Center of mass density profiles of pyrrole from a simulation of an rectangular box with pure pyrrole simulated at 295K in HDF5 format.
Hierarchical Data Format - 878.7 KB - MD5: c2bf72bbde5ce08b6efd60fc467eff44
Diffusion profile of the center of mass of pyrrole along the simulation box determined using the Smoluchowski method from a simulation of a rectangular box with pure pyrrole simulated at 295K in HDF5 format.
Hierarchical Data Format - 16.9 KB - MD5: 4b559f85b2d9437d403bfa7fdbd2455d
Center of mass density profiles of tetrahydrofuran from a simulation of an rectangular box with pure tetrahydrofuran simulated at 295K in HDF5 format.
Hierarchical Data Format - 878.7 KB - MD5: b7820312a3ccf83862477ffb2483e8c0
Diffusion profile of the center of mass of tetrahydrofuran along the simulation box determined using the Smoluchowski method from a simulation of a rectangular box with pure tetrahydrofuran simulated at 295K in HDF5 format.
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