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Table B.2

Parameters of the Lennard-Jones potential for neutral-neutral interaction.

Species Lennard-Jones
parameters Polarizabilities


ɛkb σ Ref. α Ref.
[K] [Å] [Å3]
Fe 7556 2.467 1 8.40 5
FeO 150 4.436 1 9.17 6
Mg 1614 2.926 2 10.6 5
MgO 150 4.454 1 11.37 6
Si 3036 2.91 2 5.38 5
SiO 569 3.374 2 6.15 6
SiO2 2954 3.706 2 6.92 6
Na 1375 3.567 2 24.08 5
NaO 50 3.812 2 24.85 6
Ca 2954 4.517 1 22.8 5
CaO 100 4.650 1 23.57 6
K 850 4.250 1 43.4 5
N 119 2.98 3 1.10 7
N2 71.4 3.798 4 1.74 7
NO 91.0 3.599 4 1.70 7
O 70.0 2.660 3 0.80 7
O2 106.7 3.467 4 1.58 7

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