From 1153c110781fc3add2c22ab2d996e05b0e0b10de Mon Sep 17 00:00:00 2001
From: Samo Penic <samo.penic@gmail.com>
Date: Sat, 08 Mar 2014 11:56:00 +0000
Subject: [PATCH] Merged branches polyel with constant volume
---
src/energy.c | 4 +++-
1 files changed, 3 insertions(+), 1 deletions(-)
diff --git a/src/energy.c b/src/energy.c
index 1e37e08..440f319 100644
--- a/src/energy.c
+++ b/src/energy.c
@@ -21,7 +21,9 @@
inline ts_bool bond_energy(ts_bond *bond,ts_poly *poly){
- bond->energy=poly->k*pow(bond->bond_length-1,2);
+//TODO: This value to be changed and implemented in data structure:
+ ts_double d_relaxed=1.0;
+ bond->energy=poly->k*pow(bond->bond_length-d_relaxed,2);
return TS_SUCCESS;
};
--
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