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• 23:21, 9 May 2022 Admin talk contribs created page Tutorials:localframe (Created page with "== Multipole definition and symmetry == ==== Local frame definition (in kmpole.f of tinker source). Currently POLTYPE force to use the first two types. ==== *Z-then-X (M are atom types in the parameter file) M1 MZ MX q Dx Dy Dz Qxx Qxy Qyy Qxz Qyz Qzz Note the traceless requirements: Qxx+Qyy+Qzz=0 *bisector: (e.g. for O in water) M1 M2 -M2, or M1 -M2 M2, or M1 -M2 -M2 are equivalent (e.g. in...")