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Hellmann, Robert (2020) Cross Second Virial Coefficients and Dilute Gas Transport Properties of the Systems (CO2 + C2H6) and (H2S + C2H6) from Accurate Intermolecular Potential Energy Surfaces. Journal of Chemical & Engineering Data, 65 (3) 968-979 doi:10.1021/acs.jced.9b00212

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Reference TypeJournal (article/letter/editorial)
TitleCross Second Virial Coefficients and Dilute Gas Transport Properties of the Systems (CO2 + C2H6) and (H2S + C2H6) from Accurate Intermolecular Potential Energy Surfaces
JournalJournal of Chemical & Engineering Data
AuthorsHellmann, RobertAuthor
Year2020 (March 12)Volume65
Issue3
PublisherAmerican Chemical Society (ACS)
DOIdoi:10.1021/acs.jced.9b00212Search in ResearchGate
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Mindat Ref. ID14565516Long-form Identifiermindat:1:5:14565516:9
GUID0
Full ReferenceHellmann, Robert (2020) Cross Second Virial Coefficients and Dilute Gas Transport Properties of the Systems (CO2 + C2H6) and (H2S + C2H6) from Accurate Intermolecular Potential Energy Surfaces. Journal of Chemical & Engineering Data, 65 (3) 968-979 doi:10.1021/acs.jced.9b00212
Plain TextHellmann, Robert (2020) Cross Second Virial Coefficients and Dilute Gas Transport Properties of the Systems (CO2 + C2H6) and (H2S + C2H6) from Accurate Intermolecular Potential Energy Surfaces. Journal of Chemical & Engineering Data, 65 (3) 968-979 doi:10.1021/acs.jced.9b00212
In(2020, March) Journal of Chemical & Engineering Data Vol. 65 (3) American Chemical Society (ACS)

See Also

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Hellmann, Robert (2020) Cross Second Virial Coefficients and Dilute Gas Transport Properties of the Systems (N2 + C3H8), (C2H6 + C3H8), and (H2S + C3H8) from Ab Initio-Based Intermolecular Potentials. Journal of Chemical & Engineering Data, 65 (9) 4712-4724 doi:10.1021/acs.jced.0c00605
Hellmann, Robert (2019) Cross second virial coefficients and dilute gas transport properties of the systems (CH4 + C2H6) and (N2 + C2H6) from accurate intermolecular potential energy surfaces. The Journal of Chemical Thermodynamics, 134. 175-186 doi:10.1016/j.jct.2019.03.002
Hellmann, Robert (2018) Cross Second Virial Coefficients and Dilute Gas Transport Properties of the (CH4+ C3H8) and (CO2+ C3H8) Systems from Accurate Intermolecular Potential Energy Surfaces. Journal of Chemical & Engineering Data, 63 (1) 246-257 doi:10.1021/acs.jced.7b00886
Hellmann, Robert (2020) Reference Values for the Cross Second Virial Coefficients and Dilute Gas Binary Diffusion Coefficients of the Systems (H2O + O2) and (H2O + Air) from First Principles. Journal of Chemical & Engineering Data, 65 (8) 4130-4141 doi:10.1021/acs.jced.0c00465
Hellmann, Robert (2024) Cross Second and Third Virial Coefficients and Dilute Gas Transport Properties of the (H2O + Ar) System from First-Principles Calculations. Journal of Chemical & Engineering Data, 69 (3) 942-957 doi:10.1021/acs.jced.3c00677
Hellmann, Robert (2018) Reference Values for the Second Virial Coefficient and Three Dilute Gas Transport Properties of Ethane from a State-of-the-Art Intermolecular Potential Energy Surface. Journal of Chemical & Engineering Data, 63 (2) 470-481 doi:10.1021/acs.jced.7b01069
Hellmann, Robert, Bich, Eckard, Vesovic, Velisa (2016) Cross second virial coefficients and dilute gas transport properties of the (CH 4 + CO 2 ), (CH 4 + H 2 S), and (H 2 S + CO 2 ) systems from accurate intermolecular potential energy surfaces. The Journal of Chemical Thermodynamics, 102. 429-441 doi:10.1016/j.jct.2016.07.034
Hellmann, Robert (2023) Cross Second Virial Coefficients of the H2O–H2S and H2O–SO2 Systems from First Principles. Journal of Chemical & Engineering Data, 68 (1) 108-117 doi:10.1021/acs.jced.2c00669
Hellmann, Robert (2023) Cross Second Virial Coefficients of the H2O–H2 and H2S–H2 Systems from First-Principles. Journal of Chemical & Engineering Data, 68 (9) 2212-2222 doi:10.1021/acs.jced.3c00300
Hellmann, Robert (2019) First-Principles Calculation of the Cross Second Virial Coefficient and the Dilute Gas Shear Viscosity, Thermal Conductivity, and Binary Diffusion Coefficient of the (H2O + N2) System. Journal of Chemical & Engineering Data, 64 (12) 5959-5973 doi:10.1021/acs.jced.9b00822
Hellmann, Robert, Bich, Eckard, Vogel, Eckhard (2008) Ab initio intermolecular potential energy surface and second pressure virial coefficients of methane. The Journal of Chemical Physics, 128 (21). 214303pp. doi:10.1063/1.2932103
 
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