Institute of Thermodynamics and Thermal Process Engineering

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8,541 to 8,550 of 9,299 Results

pure_tetrahydrofuran_rectangular.gro Sep 21, 2023 - Supplementary material for 'Axial Diffusion in Liquid-Saturated Cylindrical Silica Pore Models' Unknown - 9.7 MB - MD5: 401651df2e20ba3c65dc571cae7f4044 Cartesian coordinates of a simulation with 11317 tetrahydrofuran molecules in a rectangular box simulated at 295K in .gro format
pure_toluene_01k.gro Sep 21, 2023 - Supplementary material for 'Axial Diffusion in Liquid-Saturated Cylindrical Silica Pore Models' Unknown - 1010.8 KB - MD5: d2c6edc7a262819a26622d8752937c82 Cartesian coordinates of a simulation with 1000 toluene molecules simulated at 295K in .gro format
pure_toluene_05k.gro Sep 21, 2023 - Supplementary material for 'Axial Diffusion in Liquid-Saturated Cylindrical Silica Pore Models' Unknown - 4.9 MB - MD5: da71032863e5c0211368e9a25c5415a1 Cartesian coordinates of a simulation with 5000 toluene molecules simulated at 295K in .gro format
pure_toluene_10k.gro Sep 21, 2023 - Supplementary material for 'Axial Diffusion in Liquid-Saturated Cylindrical Silica Pore Models' Unknown - 9.9 MB - MD5: 8550246daa9bcda6ae855e21ed34deb7 Cartesian coordinates of a simulation with 10000 toluene molecules simulated at 295K in .gro format
pure_toluene_rectangular.gro Sep 21, 2023 - Supplementary material for 'Axial Diffusion in Liquid-Saturated Cylindrical Silica Pore Models' Unknown - 8.4 MB - MD5: 64c4f9e9eef19144212ac36192d70c53 Cartesian coordinates of a simulation with 8474 toluene molecules in a rectangular box simulated at 295K in .gro format
pure_water_rectangular.gro Sep 21, 2023 - Supplementary material for 'Axial Diffusion in Liquid-Saturated Cylindrical Silica Pore Models' Unknown - 13.4 MB - MD5: 5dfabde38774cf16e21ff94d49188263 Cartesian coordinates of a simulation with 50904 water molecules in a rectangular box simulated at 295K in .gro format
pyridine.gro Sep 21, 2023 - Supplementary material for 'Axial Diffusion in Liquid-Saturated Cylindrical Silica Pore Models' Unknown - 560 B - MD5: 06dfaf3de5baea7cd3de534d40933c8e Cartesian coordinates of a single pyridine molecule in .gro format.
pyridine.top Sep 21, 2023 - Supplementary material for 'Axial Diffusion in Liquid-Saturated Cylindrical Silica Pore Models' Unknown - 6.6 KB - MD5: d184ac5c8897bb4d42507116ce9cc137 Topology file of a pyridine molecule in .top format.
pyrrole.gro Sep 21, 2023 - Supplementary material for 'Axial Diffusion in Liquid-Saturated Cylindrical Silica Pore Models' Unknown - 515 B - MD5: 3626c1ebd3bfb6b591555fe96e5346b4 Topology file of a pyrrole molecule in .top format.
pyrrole.top Sep 21, 2023 - Supplementary material for 'Axial Diffusion in Liquid-Saturated Cylindrical Silica Pore Models' Unknown - 6.4 KB - MD5: ea9c51bd7c05a3cf3ff041ba4caacc93 Cartesian coordinates of a single pyrrole molecule in .gro format.

pure_tetrahydrofuran_rectangular.gro

Sep 21, 2023 - Supplementary material for 'Axial Diffusion in Liquid-Saturated Cylindrical Silica Pore Models'

Unknown - 9.7 MB -

Cartesian coordinates of a simulation with 11317 tetrahydrofuran molecules in a rectangular box simulated at 295K in .gro format

pure_toluene_01k.gro

Sep 21, 2023 - Supplementary material for 'Axial Diffusion in Liquid-Saturated Cylindrical Silica Pore Models'

Unknown - 1010.8 KB -

Cartesian coordinates of a simulation with 1000 toluene molecules simulated at 295K in .gro format

pure_toluene_05k.gro

Sep 21, 2023 - Supplementary material for 'Axial Diffusion in Liquid-Saturated Cylindrical Silica Pore Models'

Unknown - 4.9 MB -

Cartesian coordinates of a simulation with 5000 toluene molecules simulated at 295K in .gro format

pure_toluene_10k.gro

Sep 21, 2023 - Supplementary material for 'Axial Diffusion in Liquid-Saturated Cylindrical Silica Pore Models'

Unknown - 9.9 MB -

Cartesian coordinates of a simulation with 10000 toluene molecules simulated at 295K in .gro format

pure_toluene_rectangular.gro

Sep 21, 2023 - Supplementary material for 'Axial Diffusion in Liquid-Saturated Cylindrical Silica Pore Models'

Unknown - 8.4 MB -

Cartesian coordinates of a simulation with 8474 toluene molecules in a rectangular box simulated at 295K in .gro format

pure_water_rectangular.gro

Sep 21, 2023 - Supplementary material for 'Axial Diffusion in Liquid-Saturated Cylindrical Silica Pore Models'

Unknown - 13.4 MB -

Cartesian coordinates of a simulation with 50904 water molecules in a rectangular box simulated at 295K in .gro format

pyridine.gro

Sep 21, 2023 - Supplementary material for 'Axial Diffusion in Liquid-Saturated Cylindrical Silica Pore Models'

Unknown - 560 B -

Cartesian coordinates of a single pyridine molecule in .gro format.

pyridine.top

Sep 21, 2023 - Supplementary material for 'Axial Diffusion in Liquid-Saturated Cylindrical Silica Pore Models'

Unknown - 6.6 KB -

Topology file of a pyridine molecule in .top format.

pyrrole.gro

Sep 21, 2023 - Supplementary material for 'Axial Diffusion in Liquid-Saturated Cylindrical Silica Pore Models'

Unknown - 515 B -

Topology file of a pyrrole molecule in .top format.

pyrrole.top

Sep 21, 2023 - Supplementary material for 'Axial Diffusion in Liquid-Saturated Cylindrical Silica Pore Models'

Unknown - 6.4 KB -

Cartesian coordinates of a single pyrrole molecule in .gro format.

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