Institute of Thermodynamics and Thermal Process Engineering

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1,421 to 1,430 of 9,299 Results

force_field_mixing_rules.def Mar 7, 2025 - Supplementary material for "GPU-accelerated classical density functional theory for alkane adsorption in cationic Faujasites: accuracy and performance comparison with grand canonical Monte Carlo simulations" Plain Text - 813 B - MD5: c0156561cc2980434ce91ef55f00237e
gcmc_fixcat.input.template Mar 7, 2025 - Supplementary material for "GPU-accelerated classical density functional theory for alkane adsorption in cationic Faujasites: accuracy and performance comparison with grand canonical Monte Carlo simulations" Unknown - 1.4 KB - MD5: 64e5d355d073c28a02628d3e3e08475d
gcmc_mobcat.input.template Mar 7, 2025 - Supplementary material for "GPU-accelerated classical density functional theory for alkane adsorption in cationic Faujasites: accuracy and performance comparison with grand canonical Monte Carlo simulations" Unknown - 1.7 KB - MD5: fd9d7514fe033566ef1c46ea1933fdbe
Heat_FAU0_323K_methane_trappe.csv Mar 7, 2025 - Supplementary material for "GPU-accelerated classical density functional theory for alkane adsorption in cationic Faujasites: accuracy and performance comparison with grand canonical Monte Carlo simulations" Tabular Data - 361 B - 2 Variables, 22 Observations - UNF:6:/ZExYbc5FCDPBernEHXuAg==
isobutane.def Mar 7, 2025 - Supplementary material for "GPU-accelerated classical density functional theory for alkane adsorption in cationic Faujasites: accuracy and performance comparison with grand canonical Monte Carlo simulations" Plain Text - 861 B - MD5: 208c8fc599383dab22a244fb5fe5c442
master_torque.job.template Mar 7, 2025 - Supplementary material for "GPU-accelerated classical density functional theory for alkane adsorption in cationic Faujasites: accuracy and performance comparison with grand canonical Monte Carlo simulations" Unknown - 275 B - MD5: b6ad227aab9a6d1ceac60efb944896c1
methane.def Mar 7, 2025 - Supplementary material for "GPU-accelerated classical density functional theory for alkane adsorption in cationic Faujasites: accuracy and performance comparison with grand canonical Monte Carlo simulations" Plain Text - 609 B - MD5: 96d065e9c02ca233d4ce26373f6669c3
methane.def Mar 7, 2025 - Supplementary material for "GPU-accelerated classical density functional theory for alkane adsorption in cationic Faujasites: accuracy and performance comparison with grand canonical Monte Carlo simulations" Plain Text - 609 B - MD5: 96d065e9c02ca233d4ce26373f6669c3
npt.input.template Mar 7, 2025 - Supplementary material for "GPU-accelerated classical density functional theory for alkane adsorption in cationic Faujasites: accuracy and performance comparison with grand canonical Monte Carlo simulations" Unknown - 745 B - MD5: b16f76297a01008705d48fce5c83990f
output_FAU0_methane_323_1e+07.s0.txt Mar 7, 2025 - Supplementary material for "GPU-accelerated classical density functional theory for alkane adsorption in cationic Faujasites: accuracy and performance comparison with grand canonical Monte Carlo simulations" Plain Text - 13.5 MB - MD5: 35b801f1660de9bb17c37e87c59e2838

force_field_mixing_rules.def

Mar 7, 2025 - Supplementary material for "GPU-accelerated classical density functional theory for alkane adsorption in cationic Faujasites: accuracy and performance comparison with grand canonical Monte Carlo simulations"

Plain Text - 813 B -

gcmc_fixcat.input.template

Mar 7, 2025 - Supplementary material for "GPU-accelerated classical density functional theory for alkane adsorption in cationic Faujasites: accuracy and performance comparison with grand canonical Monte Carlo simulations"

Unknown - 1.4 KB -

gcmc_mobcat.input.template

Mar 7, 2025 - Supplementary material for "GPU-accelerated classical density functional theory for alkane adsorption in cationic Faujasites: accuracy and performance comparison with grand canonical Monte Carlo simulations"

Unknown - 1.7 KB -

Heat_FAU0_323K_methane_trappe.csv

Mar 7, 2025 - Supplementary material for "GPU-accelerated classical density functional theory for alkane adsorption in cationic Faujasites: accuracy and performance comparison with grand canonical Monte Carlo simulations"

Tabular Data - 361 B - 2 Variables, 22 Observations -