[ViewVC] Diff of: group/trunk/OOPSE-4/forceFields/SuttonChen.frc

Comparing trunk/OOPSE-4/forceFields/SuttonChen.frc (file contents):
Revision 2542 by chuckv, Tue Jan 10 22:55:08 2006 UTC vs.
Revision 2561 by chuckv, Fri Jan 13 00:09:34 2006 UTC

#	Line 6 \| Line 6 \| begin Options
6		DistanceMixingRule Geometric
7		EnergyMixingRule Geometric
8		// energy unit are eV. Convert to kcal/mol
9	<	EnergyUnitScaling 23.060523
9	>	EnergyUnitScaling 23.0605423
10		cutoffPolicy MIX
11		end Options
12
#	Line 27 \| Line 27 \| Ni 0.0015714 39.755 6.0 9.0 3.52
27
28		begin SCAtomTypes
29		// Name epsilon(eV) c m n alpha(angstroms)
30	<	Ni 0.0015714 39.755 6.0 9.0 3.52
31	<	Cu 0.0012386 39.755 6.0 9.0 3.61
32	<	Rh 0.00049371 145.658 6.0 12.0 3.80
33	<	Pd 0.00041790 108.526 7.0 12.0 3.89
34	<	Ag 0.00025415 145.658 6.0 12.0 4.09
35	<	Ir 0.00024489 337.831 6.0 14.0 3.84
36	<	Pt 0.0019835 34.428 8.0 10.0 3.92
37	<	Au 0.0012794 34.428 8.0 10.0 4.08
38	<	Pb 0.00055772 45.882 7.0 10.0 4.95
39	<	Al 0.0033307 16.460 6.0 7.0 4.05
30	>	Ni 0.015714 39.755 6.0 9.0 3.52
31	>	Cu 0.012386 39.755 6.0 9.0 3.61
32	>	Rh 0.0049371 145.658 6.0 12.0 3.80
33	>	Pd 0.0041790 108.526 7.0 12.0 3.89
34	>	Ag 0.0025415 145.658 6.0 12.0 4.09
35	>	Ir 0.0024489 337.831 6.0 14.0 3.84
36	>	Pt 0.019835 34.428 8.0 10.0 3.92
37	>	Au 0.012896 34.428 8.0 10.0 4.08
38	>	Pb 0.0055772 45.882 7.0 10.0 4.95
39	>	Al 0.033307 16.460 6.0 7.0 4.05
40		end SCAtomTypes

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