X-Git-Url: https://hackdaworld.org/gitweb/?p=physik%2Fposic.git;a=blobdiff_plain;f=moldyn.c;h=056047cad6eee1dd499bf1c22f1cff021b9e4b00;hp=d3d63eb844ff7c1f0e2bd7dd59f2aa5d87d38a1f;hb=fbf49170d213d948e9523d727a76b5337de90a05;hpb=2998bed05e84541809a34de696eeb1a9267ffe4d diff --git a/moldyn.c b/moldyn.c index d3d63eb..056047c 100644 --- a/moldyn.c +++ b/moldyn.c @@ -2283,7 +2283,9 @@ int velocity_verlet(t_moldyn *moldyn) { delta.y=-delta.x; } #endif +#ifndef QUENCH v3_add(&(atom[i].r),&(atom[i].r),&delta); +#endif v3_scale(&delta,&(atom[i].f),h*tau_square); #ifdef CONSTRAINT_110_5832 if(i==5832) {