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7,901 to 7,910 of 8,106 Results
DFT_TpPA_298_nitrogen.tab
Jul 12, 2021 - Supplementary material for 'Adsorption of Light Gases in Covalent Organic Frameworks: Comparison of Classical Density Functional Theory and Grand Canonical Monte Carlo Simulations'
Tabular Data - 6.3 KB - 1 Variables, 51 Observations - UNF:6:Fi+yFKSqvDI9TZwra9FD2g==
DFT_TpPA.xyz
Jul 12, 2021 - Supplementary material for 'Adsorption of Light Gases in Covalent Organic Frameworks: Comparison of Classical Density Functional Theory and Grand Canonical Monte Carlo Simulations'
Co-Ordinate Animation - 164.5 KB - MD5: e59ac5d95c4ece4ca09d79136789c5e9
force_field.def
Jul 12, 2021 - Supplementary material for 'Adsorption of Light Gases in Covalent Organic Frameworks: Comparison of Classical Density Functional Theory and Grand Canonical Monte Carlo Simulations'
Plain Text - 88 B - MD5: 9a8515f63bb182941cf1da31250f9ab3
force_field_mixing_rules.def
Jul 12, 2021 - Supplementary material for 'Adsorption of Light Gases in Covalent Organic Frameworks: Comparison of Classical Density Functional Theory and Grand Canonical Monte Carlo Simulations'
Plain Text - 946 B - MD5: 792afd849177c32e9aa51e51ebd45c37
formatting.cpython-37.pyc
Jul 12, 2021 - Supplementary material for 'Adsorption of Light Gases in Covalent Organic Frameworks: Comparison of Classical Density Functional Theory and Grand Canonical Monte Carlo Simulations'
Unknown - 2.5 KB - MD5: af6109279d31098a114ba0bfb3135a21
formatting.py
Jul 12, 2021 - Supplementary material for 'Adsorption of Light Gases in Covalent Organic Frameworks: Comparison of Classical Density Functional Theory and Grand Canonical Monte Carlo Simulations'
Python Source Code - 2.9 KB - MD5: c354d94c5b340202c18118973cd85742
GCMC_Dha_298_ethane_fug.tab
Jul 12, 2021 - Supplementary material for 'Adsorption of Light Gases in Covalent Organic Frameworks: Comparison of Classical Density Functional Theory and Grand Canonical Monte Carlo Simulations'
Tabular Data - 2.1 KB - 1 Variables, 42 Observations - UNF:6:njPZyZDy24D1qsYSqvb68g==
GCMC_Dha_298_ethane.tab
Jul 12, 2021 - Supplementary material for 'Adsorption of Light Gases in Covalent Organic Frameworks: Comparison of Classical Density Functional Theory and Grand Canonical Monte Carlo Simulations'
Tabular Data - 2.2 KB - 1 Variables, 51 Observations - UNF:6:9voH8l3B5C3eTF0fVI18Vw==
GCMC_Dha_298_methane_ethane_x01.tab
Jul 12, 2021 - Supplementary material for 'Adsorption of Light Gases in Covalent Organic Frameworks: Comparison of Classical Density Functional Theory and Grand Canonical Monte Carlo Simulations'
Tabular Data - 696 B - 1 Variables, 11 Observations - UNF:6:3I1bz9cfYDkyGRQ5X4Evqg==
GCMC_Dha_298_methane_ethane_x04.tab
Jul 12, 2021 - Supplementary material for 'Adsorption of Light Gases in Covalent Organic Frameworks: Comparison of Classical Density Functional Theory and Grand Canonical Monte Carlo Simulations'
Tabular Data - 706 B - 1 Variables, 11 Observations - UNF:6:2MLHy2R2ZgcrqQ8DYwfo8w==
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