Searched refs:ljc14 (Results 1 – 5 of 5) sorted by relevance
173 iparams.ljc14.fqq, iparams.ljc14.qi, iparams.ljc14.qj, in printInteractionParameters()174 iparams.ljc14.c6, iparams.ljc14.c12); in printInteractionParameters()
128 } ljc14; member
269 newparam->ljc14.fqq = old[0]; in assign_param()270 newparam->ljc14.qi = old[1]; in assign_param()271 newparam->ljc14.qj = old[2]; in assign_param()272 set_ljparams(comb, reppow, old[3], old[4], &newparam->ljc14.c6, &newparam->ljc14.c12); in assign_param()
441 qq = iparams[itype].ljc14.qi * iparams[itype].ljc14.qj * epsfac in do_pairs_general()442 * iparams[itype].ljc14.fqq; in do_pairs_general()443 c6 = iparams[itype].ljc14.c6; in do_pairs_general()444 c12 = iparams[itype].ljc14.c12; in do_pairs_general()
1879 serializer->doReal(&iparams->ljc14.fqq); in do_iparams()1880 serializer->doReal(&iparams->ljc14.qi); in do_iparams()1881 serializer->doReal(&iparams->ljc14.qj); in do_iparams()1882 serializer->doReal(&iparams->ljc14.c6); in do_iparams()1883 serializer->doReal(&iparams->ljc14.c12); in do_iparams()