Comparing trunk/OOPSE/libmdtools/EAM_FF.cpp (file contents):
Revision 940 by mmeineke, Mon Nov 10 21:50:36 2003 UTC vs.
Revision 941 by gezelter, Tue Jan 13 23:01:43 2004 UTC
449 |
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int isDipole = 0; |
450 |
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int isSSD = 0; |
451 |
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int isGB = 0; |
452 |
< |
int isEAM= 1; |
452 |
> |
int isEAM = 1; |
453 |
> |
int isCharge = 0; |
454 |
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double dipole = 0.0; |
455 |
+ |
double charge = 0.0; |
456 |
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double eamSigma = 0.0; |
457 |
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double eamEpslon = 0.0; |
458 |
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|
467 |
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&isDipole, |
468 |
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&isGB, |
469 |
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&isEAM, |
470 |
+ |
&isCharge, |
471 |
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&eamEpslon, |
472 |
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&eamSigma, |
473 |
+ |
&charge, |
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&dipole, |
475 |
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&isError ); |
476 |
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if( isError ){ |
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