# | Line 14 | Line 14 | molecule{ | |
---|---|---|
14 | name = "Na+"; | |
15 | nAtoms = 1; | |
16 | atom[0]{ | |
17 | < | type = "Na+"; |
17 | > | type = "Na"; |
18 | position(0.0, 0.0, 0.0); | |
19 | } | |
20 | } | |
# | Line 60 | Line 60 | molecule{ | |
60 | } | |
61 | ||
62 | molecule{ | |
63 | + | name = "TAP"; |
64 | + | nAtoms = 1; |
65 | + | atom[0]{ |
66 | + | type = "TAP"; |
67 | + | position( 0.0, 0.0, 0.0 ); |
68 | + | orientation( 0.0, 0.0, 0.0 ); |
69 | + | } |
70 | + | } |
71 | + | |
72 | + | molecule{ |
73 | name = "TIP3P"; | |
74 | nAtoms = 3; | |
75 | atom[0]{ |
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+ | Added lines |
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