[cig-commits] [commit] add_thermodynamic_potentials: Added vacancy (Vc) to list of atomic masses (for solid solution formula parsing) (83c31a2)

[cig_noreply at geodynamics.org]

Repository : https://github.com/geodynamics/burnman

On branch  : add_thermodynamic_potentials
Link       : https://github.com/geodynamics/burnman/compare/f9a1e215ff875e89f69b5e717b85d9af5d44e93b...83c31a2149ddfb6f77c6a72fb5cf3eef08996a42

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commit 83c31a2149ddfb6f77c6a72fb5cf3eef08996a42
Author: Bob Myhill <myhill.bob at gmail.com>
Date:   Tue Nov 11 22:07:10 2014 +0100

    Added vacancy (Vc) to list of atomic masses (for solid solution formula parsing)


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83c31a2149ddfb6f77c6a72fb5cf3eef08996a42
 burnman/data/input_masses/atomic_masses.dat | 3 ++-
 1 file changed, 2 insertions(+), 1 deletion(-)

diff --git a/burnman/data/input_masses/atomic_masses.dat b/burnman/data/input_masses/atomic_masses.dat
index 2e52ed3..86d3d92 100644
--- a/burnman/data/input_masses/atomic_masses.dat
+++ b/burnman/data/input_masses/atomic_masses.dat
@@ -1,5 +1,6 @@
 % Masses from NIST
-% Processed with `awk '{print substr($0,5, 4), substr($0,47,100)}' tmp  | sed 's/_//g' | awk '{print $1, $2/1000.}' | awk 'NF==2' | awk -F"(" '{print $1}' | grep -v '['`
+% Vc = vacancy. Everything else processed with `awk '{print substr($0,5, 4), substr($0,47,100)}' NIST_masses.dat  | sed 's/_//g' | awk '{print $1, $2/1000.}' | awk 'NF==2' | awk -F"(" '{print $1}' | grep -v '['`
+Vc 0.0000000
 H 0.00100794
 He 0.0040026
 Li 0.006941