Searched refs:rasnorm (Results 1 – 1 of 1) sorted by relevance
104 disp6_contrib(double rasnorm, double d6) in disp6_contrib() argument108 edisp6_contrib = d6/(3*pow(rasnorm,6.0)); // atomic units in disp6_contrib()114 disp8_contrib(double rasnorm, double d8) in disp8_contrib() argument118 edisp8_contrib = d8/(5*pow(rasnorm,8.0)); // atomic units in disp8_contrib()124 disp10_contrib(double rasnorm, double d10) in disp10_contrib() argument138 edisp_contrib = d6/(3*pow(rasnorm,6.0)) + d8/(5*pow(rasnorm,8.0)) in disp_contrib()139 + d10/(7*pow(rasnorm,10.0)); in disp_contrib()157 tmp = gamma*rasnorm/(2.0*sqrt(ri_vdw*rj_vdw)); in rep_contrib()178 double rasnorm; in disprep() local271 rasnorm = ras.norm(); in disprep()[all …]