From 59c7f5f163b6d8997df61dc393e195cd3ee47ff1 Mon Sep 17 00:00:00 2001 From: Miha <mihaf@beti.(none)> Date: Fri, 13 Jul 2012 15:56:06 +0000 Subject: [PATCH] nmax added to counting. --- src/general.h | 3 +++ 1 files changed, 3 insertions(+), 0 deletions(-) diff --git a/src/general.h b/src/general.h index 87c6174..f3328f6 100644 --- a/src/general.h +++ b/src/general.h @@ -169,6 +169,7 @@ ts_vertex *vtx2; ts_double bond_length; ts_double bond_length_dual; + ts_bool tainted; }; typedef struct ts_bond ts_bond; @@ -217,6 +218,8 @@ typedef struct { ts_uint l; ts_double **ulm; + ts_double **sumUlm2; + ts_uint N; ts_double **co; ts_double ***Ylmi; } ts_spharm; -- Gitblit v1.9.3