Optimized atomic Lennard-Jones 6-12 parameters for simulating pVT properties of a realistic polymethylene melt

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J Chem Phys | / 14卷 / 5761期

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[21] EXPERIMENTAL-DETERMINATION OF C6 AND C-12 CONSTANTS OF POTENTIAL OF LENNARD-JONES (6-12) INTERACTION
VORONOV, AM
ZHURAVLEV, VN
PISMA V ZHURNAL TEKHNICHESKOI FIZIKI, 1993, 19 (07): : 51 - 54
[22] SELF-CONSISTENT APPROXIMATION AND FIFTH VIRIAL-COEFFICIENTS FOR LENNARD-JONES 6-12 POTENTIAL
SWAMY, KN
ZEITSCHRIFT FUR PHYSIKALISCHE CHEMIE-FRANKFURT, 1973, 85 (5-6): : 249 - 255
[23] SELF-CONSISTENT APPROXIMATION AND FOURTH VIRIAL-COEFFICIENTS FOR LENNARD-JONES 6-12 POTENTIAL
RAO, RVG
SWAMY, KN
INDIAN JOURNAL OF PURE & APPLIED PHYSICS, 1972, 10 (01) : 10 - +
[24] THE PVT PROPERTIES OF NITROGEN FROM -20-DEGREES-C TO +35-DEGREES-C AND 200 TO 570 MPA, AND SOME COMPARISONS WITH ARGON AND THE LENNARD-JONES (6-12) FLUID
MORRIS, EC
WYLIE, RG
JOURNAL OF CHEMICAL PHYSICS, 1983, 79 (06): : 2982 - 2988
[25] NUMERICAL SOLUTIONS OF PERCUS-YEVICK EQUATION FOR LENNARD-JONES (6-12) AND HARD-SPHERE POTENTIALS
MANDEL, F
BEARMAN, RJ
BEARMAN, MY
JOURNAL OF CHEMICAL PHYSICS, 1970, 52 (07): : 3315 - &
[26] PROPERTIES OF EQUATION OF STATE OF AIR BASED ON LENNARD-JONES POTENTIAL (12-6)
ZUBAREV, VN
KOZLOV, AD
KRUPINA, NL
SPIRIDONOV, GA
HIGH TEMPERATURE, 1973, 11 (06) : 1053 - 1056
[27] ESTIMATION OF LENNARD-JONES [6,12) PAIR POTENTIAL PARAMETERS FROM GAS SOLUBILITY DATA
WILHELM, E
BATTINO, R
JOURNAL OF CHEMICAL PHYSICS, 1971, 55 (08): : 4012 - &
[28] Uncertainty quantification and propagation of errors of the Lennard-Jones 12-6 parameters for n-alkanes
Messerly, Richard A.
Knotts, Thomas A.
Wilding, W. Vincent
JOURNAL OF CHEMICAL PHYSICS, 2017, 146 (19):
[29] PREDICTION OF CAPILLARY CONDENSATION IN SMALL CYLINDRICAL PORES USING THE LOCAL DENSITY APPROXIMATION AND A FULL LENNARD-JONES 6-12 POTENTIAL
ELKAMEL, A
NOBLE, RD
JOURNAL OF PHYSICAL CHEMISTRY, 1991, 95 (24): : 10076 - 10080
[30] A SHORTER METHOD OF CALCULATING LENNARD-JONES (12-6) POTENTIAL PARAMETERS FROM GAS VISCOSITY DATA
HAWKSWORTH, W
JOURNAL OF CHEMICAL PHYSICS, 1961, 35 (04): : 1534 - &

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