Commit aa87f555 authored by eric pellegrini's avatar eric pellegrini
Browse files

repopulate MDANSE

parent 98d3a13b
name = "carbon"
symbol = "c14"
mass = 14.00324199
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name = "calcium"
symbol = "ca"
mass = 40.078
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name = "calcium"
symbol = "ca40"
mass = 39.9625912
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name = "calcium"
symbol = "ca42"
mass = 41.9586183
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name = "calcium"
symbol = "ca43"
mass = 42.9587668
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name = "calcium"
symbol = "ca44"
mass = 43.9554811
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name = "calcium"
symbol = "ca46"
mass = 45.9536928
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name = "calcium"
symbol = "ca48"
mass = 47.952534
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name = "cadmium"
symbol = "cd"
mass = 112.411
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name = 'CD1'
symbol = 'C'
atomic_number = 6 + 1
atomic_number_deut = 6 + 1
mass = 12.0110369031 + 2.014102
mass_deut = 12.0110369031 + 2.014102
color = 'black'
vdW_radius = 0.17
name = "cadmium"
symbol = "cd106"
mass = 105.906458
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name = "cadmium"
symbol = "cd108"
mass = 107.904183
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name = "cadmium"
symbol = "cd110"
mass = 109.903006
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name = "cadmium"
symbol = "cd111"
mass = 110.904182
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name = "cadmium"
symbol = "cd112"
mass = 111.9027572
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name = "cadmium"
symbol = "cd113"
mass = 112.9044009
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name = "cadmium"
symbol = "cd114"
mass = 113.9033581
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name = "cadmium"
symbol = "cd116"
mass = 115.904755
\ No newline at end of file
name = 'CD2'
symbol = 'C'
atomic_number = 6 + 2
atomic_number_deut = 6 + 2
mass = 12.0110369031 + 2*2.014102
mass_deut = 12.0110369031 + 2*2.014102
color = 'black'
vdW_radius = 0.17
name = 'CD3'
symbol = 'C'
atomic_number = 6 + 3
atomic_number_deut = 6 + 3
mass = 12.0110369031 + 3*2.014102
mass_deut = 12.0110369031 + 3*2.014102
color = 'black'
vdW_radius = 0.17
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