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Searched refs:qxxi (Results 1 – 5 of 5) sorted by relevance

/dports/science/tinker/tinker/source/
H A Desolv1.f786 real*8 qxxi,qxyi,qxzi local
889 qxxi = rpole(5,ii)
1448 & +ck*(qxxi*gc(5)+qyyi*gc(8)+qzzi*gc(10)
1830 & +qxxi*gqxx(5)+qyyi*gqxx(8)+qzzi*gqxx(10)
1833 & +qxxi*gqxx(5)+qyyi*gqyy(5)+qzzi*gqzz(5)
1837 & +qxxi*gqxy(5)+qyyi*gqxy(8)+qzzi*gqxy(10)
1840 & +qxxi*gqxx(6)+qyyi*gqyy(6)+qzzi*gqzz(6)
1844 & +qxxi*gqxz(5)+qyyi*gqxz(8)+qzzi*gqxz(10)
1847 & +qxxi*gqxx(7)+qyyi*gqyy(7)+qzzi*gqzz(7)
1854 & +qxxi*gqxx(8)+qyyi*gqyy(8)+qzzi*gqzz(8)
[all …]
H A Desolv.f561 real*8 qxxi,qxyi,qxzi local
616 qxxi = rpole(5,ii)
826 & + ck*(qxxi*gqxx(1)+qyyi*gqyy(1)+qzzi*gqzz(1)
856 & + ck*(qxxi*gc(5)+qyyi*gc(8)+qzzi*gc(10)
864 & + uxk*(qxxi*gux(5)+qyyi*gux(8)+qzzi*gux(10)
866 & + uyk*(qxxi*guy(5)+qyyi*guy(8)+qzzi*guy(10)
868 & + uzk*(qxxi*guz(5)+qyyi*guz(8)+qzzi*guz(10)
900 & + dxk*(qxxi*gqxx(2)+qyyi*gqyy(2)+qzzi*gqzz(2)
914 & + dxk*(qxxi*gux(5)+qyyi*gux(8)+qzzi*gux(10)
916 & + dyk*(qxxi*guy(5)+qyyi*guy(8)+qzzi*guy(10)
[all …]
H A Desolv3.f715 real*8 qxxi,qxyi,qxzi local
784 qxxi = rpole(5,ii)
994 & + ck*(qxxi*gqxx(1)+qyyi*gqyy(1)+qzzi*gqzz(1)
1024 & + ck*(qxxi*gc(5)+qyyi*gc(8)+qzzi*gc(10)
1032 & + uxk*(qxxi*gux(5)+qyyi*gux(8)+qzzi*gux(10)
1034 & + uyk*(qxxi*guy(5)+qyyi*guy(8)+qzzi*guy(10)
1036 & + uzk*(qxxi*guz(5)+qyyi*guz(8)+qzzi*guz(10)
1068 & + dxk*(qxxi*gqxx(2)+qyyi*gqyy(2)+qzzi*gqzz(2)
1082 & + dxk*(qxxi*gux(5)+qyyi*gux(8)+qzzi*gux(10)
1084 & + dyk*(qxxi*guy(5)+qyyi*guy(8)+qzzi*guy(10)
[all …]
H A Dinduce.f4924 real*8 qxxi,qxyi,qxzi local
5025 qxxi = rpole(5,ii)
5147 qix = qxxi*xr + qxyi*yr + qxzi*zr
5303 & - 0.5d0 * (ci*gux(1) + qxxi*gux(5)
5307 & - 0.5d0 * (ci*gc(2) + qxxi*gqxx(2)
5312 & - 0.5d0 * (ci*guy(1) + qxxi*guy(5)
5316 & - 0.5d0 * (ci*gc(3) + qxxi*gqxx(3)
5321 & - 0.5d0 * (ci*guz(1) + qxxi*guz(5)
5325 & - 0.5d0 * (ci*gc(4) + qxxi*gqxx(4)
/dports/science/tinker/tinker/other/
H A Dinduce.no-tarray3648 real*8 qxxi,qxyi,qxzi
3737 qxxi = rpole(5,i)
3819 qix = qxxi*xr + qxyi*yr + qxzi*zr
3975 & - 0.5d0 * (ci*gux(1) + qxxi*gux(5)
3979 & - 0.5d0 * (ci*gc(2) + qxxi*gqxx(2)
3984 & - 0.5d0 * (ci*guy(1) + qxxi*guy(5)
3988 & - 0.5d0 * (ci*gc(3) + qxxi*gqxx(3)
3993 & - 0.5d0 * (ci*guz(1) + qxxi*guz(5)
3997 & - 0.5d0 * (ci*gc(4) + qxxi*gqxx(4)