141 |
|
double factor; |
142 |
|
double spaceTrq[3]; |
143 |
|
double omegaPass; |
144 |
– |
double omega; |
144 |
|
|
145 |
|
tolerance = 5.72957795131e-7; |
146 |
|
|
275 |
|
if (!angleIn) { |
276 |
|
sprintf(painCave.errMsg, |
277 |
|
"Restraints Warning: The lack of a zAngle.ang file is mildly\n" |
278 |
< |
"\tunsettling... This means you arestarting from the idealCrystal.in\n" |
279 |
< |
"\treference configuration, so the omega values will all be set to\n" |
280 |
< |
"\tzero. If this isn't the case, you should question your results.\n"); |
278 |
> |
"\tunsettling... This means the simulation is starting from the\n" |
279 |
> |
"\tidealCrystal.in reference configuration, so the omega values\n" |
280 |
> |
"\twill all be set to zero. If this is not the case, you should\n" |
281 |
> |
"\tquestion your results.\n"); |
282 |
|
painCave.isFatal = 0; |
283 |
|
simError(); |
284 |
|
} |