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lines changed Original file line number Diff line number Diff line change 1+ #p rhf/3-21g test geom=modela pop=mk
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3+ Gaussian Test Job 200 (Part 1):
4+ Methanol charges via electrostatic potential fit
5+
6+ 0,1
7+ o h me
8+
9+ --Link1--
10+ #p rhf/3-21g pop=(mk,dipole) test geom=modela
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12+ Gaussian Test Job 200 (Part 2):
13+ Methanol charges via electrostatic potential fit with dipole constraint
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15+ 0,1
16+ o h me
17+
18+ --Link1--
19+ #p rhf/3-21g pop=(mk,atomdipole) test geom=modela
20+
21+ Gaussian Test Job 200 (Part 3):
22+ Methanol charges via electrostatic potential fit with dipole constraint
23+
24+ 0,1
25+ o h me
26+
27+ --Link1--
28+ #p rhf/3-21g test geom=modela pop=chelp
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30+ Gaussian Test Job 200 (Part 4):
31+ Methanol charges via electrostatic potential fit with Chirlian-Francl grid
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33+ 0,1
34+ o h me
35+
36+ --Link1--
37+ #p rhf/3-21g test geom=modela pop=chelpg
38+
39+ Gaussian Test Job 200 (Part 5):
40+ Methanol charges via electrostatic potential fit with Brenneman grid
41+
42+ 0,1
43+ o h me
44+
45+ --Link1--
46+ #p rhf/3-21g test geom=modela pop=(chelpg,readrad)
47+
48+ Gaussian Test Job 200 (Part 6):
49+ Methanol charges via electrostatic potential fit with Brenneman grid
50+
51+ 0,1
52+ o h me
53+
54+ h 1.1
55+
56+ --Link1--
57+ #p rhf/3-21g test geom=modela pop=(chelpg,readatrad)
58+
59+ Gaussian Test Job 200 (Part 7):
60+ Methanol charges via electrostatic potential fit with Brenneman grid
61+
62+ 0,1
63+ o h me
64+
65+ 2 1.1
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