From: hackbard <hackbard@sage.physik.uni-augsburg.de>
Date: Tue, 19 Aug 2008 14:45:06 +0000 (+0200)
Subject: added debug aattr print + initialize nnd for 'none' lattice manually
X-Git-Url: https://hackdaworld.org/gitweb/?a=commitdiff_plain;h=d6833a9f3e7ab752d54f1108c15fc3a95f8214ed;p=physik%2Fposic.git

added debug aattr print + initialize nnd for 'none' lattice manually
---

diff --git a/mdrun.c b/mdrun.c
index 1368880..af8a352 100644
--- a/mdrun.c
+++ b/mdrun.c
@@ -836,6 +836,7 @@ int chaatr(t_moldyn *moldyn,t_mdrun *mdrun) {
 		}
 		atom->attr=cap->attr;
 	}
+	printf("     atom attributes: %02x\n\n",cap->attr);
 
 	return 0;
 }
@@ -1127,6 +1128,7 @@ int main(int argc,char **argv) {
 			               mdrun.ly,mdrun.lz,&o);
 			break;
 		case NONE:
+			set_nn_dist(&moldyn,mdrun.nnd);
 			break;
 		default:
 			printf("%s unknown lattice type: %02x\n",