From 36bc6d58f7f1b83ae07c00ce7f42755bedbcff18 Mon Sep 17 00:00:00 2001 From: Samo Penic <samo.penic@gmail.com> Date: Mon, 11 Feb 2019 21:17:55 +0000 Subject: [PATCH] Fixed duplicated stretchswitch and xkA0 while parsing tape --- src/tspoststat.c | 7 ++++--- 1 files changed, 4 insertions(+), 3 deletions(-) diff --git a/src/tspoststat.c b/src/tspoststat.c index 6a4b8fb..f518000 100644 --- a/src/tspoststat.c +++ b/src/tspoststat.c @@ -105,11 +105,11 @@ ts_uint tstep,n; ts_char *number; struct dirent **list; - ts_double l1,l2,l3; + ts_double l1,l2,l3,hbar; int count; ts_fprintf(stderr,"TRISURF-NG v. %s, compiled on: %s %s.\n", TS_VERSION, __DATE__, __TIME__); - fprintf(stdout, "OuterLoop Volume Area lamdba1 lambda2 lambda3 Nbw/Nb\n"); + fprintf(stdout, "OuterLoop Volume Area lamdba1 lambda2 lambda3 Nbw/Nb hbar\n"); count=scandir(".",&list,0,alphasort); @@ -136,7 +136,8 @@ vesicle_volume(vesicle); vesicle_area(vesicle); gyration_eigen(vesicle,&l1,&l2,&l3); - fprintf(stdout,"%d %.17e %.17e %.17e %.17e %.17e %.17e\n",atoi(number),vesicle->volume, vesicle->area,l1,l2,l3, (ts_double)count_bonds_with_energy(vesicle->blist)/(ts_double)vesicle->blist->n), + hbar=vesicle_meancurvature(vesicle)/vesicle->area; + fprintf(stdout,"%d %.17e %.17e %.17e %.17e %.17e %.17e %.17e\n",atoi(number),vesicle->volume, vesicle->area,l1,l2,l3, (ts_double)count_bonds_with_energy(vesicle->blist)/(ts_double)vesicle->blist->n,hbar); tstep++; write_histogram_data(atoi(number), vesicle); free(number); -- Gitblit v1.9.3