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Linked jobs #29

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bgpeyton opened this issue Jun 5, 2018 · 0 comments
Open

Linked jobs #29

bgpeyton opened this issue Jun 5, 2018 · 0 comments

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@bgpeyton
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bgpeyton commented Jun 5, 2018

Turns out that G09's Test.FChk system doesn't work very well for linked jobs. Instead of appending information to the bottom of the file, it simply over-writes it such that all you get at the end of the calculation is the information from the last linked job. So for now, anything that requires linked jobs (such as rotations + polarizabilities of the same molecule) need to be run separately.

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