c c _____________________________ c c subroutine presymm(qq,lindex,qresult) real qq(4),qresult(4) integer lindex c include 'common.f' common/a1/ quatsymm(4,48),numsymm c PI=3.14159265 c c algorithm for forming resultant quaternion c from applying a symmetry operator, QUATSYMM(n,lindex) c to the first quaternion/rotation c c If the symm oper == O, then c Qresult = (O x QQ) where QQ= Q1 x Q2^-1 c i.e. Qresult = (O x Q1) x Q2^-1 c note change of signs to get inverse of first orientation c if(lindex.gt.numsymm) stop 'error in presymm, lindex>numsymm' if(lindex.lt.1) stop 'error in presymm, lindex<1' qresult(1)=quatsymm(4,lindex)*qq(1)+quatsymm(1,lindex)*qq(4) & +quatsymm(3,lindex)*qq(2)-quatsymm(2,lindex)*qq(3) qresult(2)=quatsymm(4,lindex)*qq(2)+quatsymm(2,lindex)*qq(4) & +quatsymm(1,lindex)*qq(3)-quatsymm(3,lindex)*qq(1) qresult(3)=quatsymm(4,lindex)*qq(3)+quatsymm(3,lindex)*qq(4) & +quatsymm(2,lindex)*qq(1)-quatsymm(1,lindex)*qq(2) qresult(4)=quatsymm(4,lindex)*qq(4)-quatsymm(1,lindex)*qq(1) & -quatsymm(2,lindex)*qq(2)-quatsymm(3,lindex)*qq(3) c c write(*,*) 'qresult ',qresult c return end c c c _____________________________ c