# | Line 39 | Line 39 | void DirectionalAtom::setQ( double the_q[4] ){ | |
---|---|---|
39 | Azz = q0Sqr - q1Sqr -q2Sqr +q3Sqr; | |
40 | } | |
41 | ||
42 | + | void DirectionalAtom::getA( double the_A[3][3] ){ |
43 | + | |
44 | + | A[0][0] = Axx; |
45 | + | A[0][1] = Axy; |
46 | + | A[0][2] = Axz; |
47 | + | |
48 | + | A[1][0] = Ayx; |
49 | + | A[1][1] = Ayy; |
50 | + | A[1][2] = Ayz; |
51 | + | |
52 | + | A[2][0] = Azx; |
53 | + | A[2][1] = Azy; |
54 | + | A[2][2] = Azz; |
55 | + | } |
56 | + | |
57 | + | |
58 | void DirectionalAtom::getU( double the_u[3] ){ | |
59 | ||
60 | the_u[0] = sux; |
– | Removed lines |
+ | Added lines |
< | Changed lines |
> | Changed lines |