mailr20710 - /branches/relax_disp/lib/dispersion/tp02.py


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Posted by edward on August 29, 2013 - 15:57:
Author: bugman
Date: Thu Aug 29 15:57:35 2013
New Revision: 20710

URL: http://svn.gna.org/viewcvs/relax?rev=20710&view=rev
Log:
The TP02 dispersion model now assumes the chemical shift is that of the major 
population A.

Previously the linear chemical shift average was assumed.


Modified:
    branches/relax_disp/lib/dispersion/tp02.py

Modified: branches/relax_disp/lib/dispersion/tp02.py
URL: 
http://svn.gna.org/viewcvs/relax/branches/relax_disp/lib/dispersion/tp02.py?rev=20710&r1=20709&r2=20710&view=diff
==============================================================================
--- branches/relax_disp/lib/dispersion/tp02.py (original)
+++ branches/relax_disp/lib/dispersion/tp02.py Thu Aug 29 15:57:35 2013
@@ -67,9 +67,8 @@
     """
 
     # Repetitive calculations (to speed up calculations).
-    half_dw = dw / 2.0
-    Wa = omega - half_dw        # Larmor frequency [s^-1].
-    Wb = omega + half_dw        # Larmor frequency [s^-1].
+    Wa = omega                  # Larmor frequency [s^-1].
+    Wb = omega + dw             # Larmor frequency [s^-1].
     kex2 = kex**2
 
     # The numerator.




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