gwm17/catima
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compund added

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hrocho 2018-05-08 14:43:34 +02:00
parent 051a2c7c34
commit 79d12742da
2 changed files with 4 additions and 2 deletions
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3
material_database.cpp
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@ -38,7 +38,7 @@ namespace catima{
case material::Methanol: return Material({{0,1,4},{0,6,1},{0,8,1}},0.792); case material::Methanol: return Material({{0,1,4},{0,6,1},{0,8,1}},0.792);
case material::Acetone: return Material({{0,1,6},{0,6,3},{0,8,1}},0.7899); case material::Acetone: return Material({{0,1,6},{0,6,3},{0,8,1}},0.7899);
case material::Acetylene: return Material({{0,1,2},{0,6,2}},0.0010967); case material::Acetylene: return Material({{0,1,2},{0,6,2}},0.0010967);
case material::Adenine: return Material({{0,1,5},{0,6,5},{0,7,5}},1.35); case material::Adenine: return Material({{0,1,5},{0,6,5},{0,7,5},{0,53,71.4}},1.35);
case material::Adipose_Tissue: return Material({{0,1,0.119477},{0,6,0.63724},{0,7,0.00797},{0,8,0.232333},{0,11,0.0005},{0,12,2e-05},{0,15,0.00016},{0,16,0.00073},{0,17,0.00119},{0,19,0.00032},{0,20,2e-05},{0,26,2e-05},{0,30,2e-05}},0.92); case material::Adipose_Tissue: return Material({{0,1,0.119477},{0,6,0.63724},{0,7,0.00797},{0,8,0.232333},{0,11,0.0005},{0,12,2e-05},{0,15,0.00016},{0,16,0.00073},{0,17,0.00119},{0,19,0.00032},{0,20,2e-05},{0,26,2e-05},{0,30,2e-05}},0.92);
case material::Alanine: return Material({{0,1,7},{0,6,3},{0,7,1},{0,8,2}},1.42); case material::Alanine: return Material({{0,1,7},{0,6,3},{0,7,1},{0,8,2}},1.42);
case material::Bakelite: return Material({{0,1,0.057441},{0,6,0.774591},{0,8,0.167968}},1.25); case material::Bakelite: return Material({{0,1,0.057441},{0,6,0.774591},{0,8,0.167968}},1.25);
@ -154,6 +154,7 @@ namespace catima{
case material::UO2: return Material({{0,8,2},{0,92,1}},10.97); case material::UO2: return Material({{0,8,2},{0,92,1}},10.97);
case material::Urea: return Material({{0,1,0.067131},{0,6,0.2},{0,7,0.466459},{0,8,0.266411}},1.323); case material::Urea: return Material({{0,1,0.067131},{0,6,0.2},{0,7,0.466459},{0,8,0.266411}},1.323);
case material::Valine: return Material({{0,1,11},{0,6,5},{0,7,1},{0,8,2}},1.23); case material::Valine: return Material({{0,1,11},{0,6,5},{0,7,1},{0,8,2}},1.23);
case material::C10H7I: return Material({{0,6,10},{0,1,7},{0,53,1}},1.738);
default:break; default:break;
} }
return Material(); return Material();

3
material_database.h
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@ -146,7 +146,8 @@ namespace catima{
UC = 339, UC = 339,
UO2 = 340, UO2 = 340,
Urea = 341, Urea = 341,
Valine = 342 Valine = 342,
C10H7I = 343
}; };
Material get_compound(material m); Material get_compound(material m);