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These examples show a simple geometry optimization of water, and a frequency calculation using the geometry results.

Files

Order By : ID | File Title | Downloads | Submit Date | Submitter | Author | Rating

water_opt.log Download

Submitted On:
10 Nov 2011
File Size:
58.63 Kb
Downloads:
25

water_opt.out Download

Submitted On:
10 Nov 2011
File Size:
2.56 Kb
Downloads:
24

water_opt Download

Submitted On:
10 Nov 2011
File Size:
0.14 Kb
Downloads:
58

water_opt.job Download

Submitted On:
10 Nov 2011
File Size:
1.33 Kb
Downloads:
40

water_freq Download

Submitted On:
10 Nov 2011
File Size:
0.15 Kb
Downloads:
58

water_freq.out Download

Submitted On:
10 Nov 2011
File Size:
2.57 Kb
Downloads:
23

water_freq.log Download

Submitted On:
10 Nov 2011
File Size:
39.57 Kb
Downloads:
26

water_freq.job Download

Submitted On:
10 Nov 2011
File Size:
1.36 Kb
Downloads:
53
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