[cig-commits] [commit] add_gibbs_energy: Added vacancies to atomic_masses.dat (b5e9ebb)

cig_noreply at geodynamics.org cig_noreply at geodynamics.org
Thu Dec 11 17:12:54 PST 2014


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

On branch  : add_gibbs_energy
Link       : https://github.com/geodynamics/burnman/compare/0000000000000000000000000000000000000000...2148b324d3e8aa7b527f831eb397590942563008

>---------------------------------------------------------------

commit b5e9ebbca9b4f4ca4bfd17db74f77df72c7cdcf9
Author: Bob Myhill <myhill.bob at gmail.com>
Date:   Tue Dec 9 10:47:03 2014 -0800

    Added vacancies to atomic_masses.dat


>---------------------------------------------------------------

b5e9ebbca9b4f4ca4bfd17db74f77df72c7cdcf9
 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



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