# | Line 46 | Line 46 | class DirectionalAtom : public Atom { (public) | |
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46 | void setJ( double theJ[3] ); | |
47 | ||
48 | void getTrq( double theT[3] ); | |
49 | + | void setTrq( double theT[3] ); |
50 | void addTrq( double theT[3] ); | |
51 | ||
52 | void setI( double the_I[3][3] ); | |
# | Line 54 | Line 55 | class DirectionalAtom : public Atom { (public) | |
55 | void lab2Body( double r[3] ); | |
56 | void body2Lab( double r[3] ); | |
57 | ||
58 | + | double getZangle( ); |
59 | + | void setZangle( double zAng ); |
60 | + | void addZangle( double zAng ); |
61 | + | |
62 | // Four functions added for derivatives with respect to Euler Angles: | |
63 | // (Needed for minimization routines): | |
64 |
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+ | Added lines |
< | Changed lines |
> | Changed lines |