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Published 20 hours ago • verified publisher icon ReactionMechanismGenerator

certain solvent library entries give "OverflowError"

Open jonwzheng opened this issue 1 year ago • 2 comments

Problem

Attempting to access solvent 96 (4-methylpentan-2-ol) gives the result OverflowError: math range error

Reproduce

Go to https://rmg.mit.edu/database/solvation/libraries/solvent/96/ , or go to https://rmg.mit.edu/database/solvation/libraries/solvent/ and navigate to entry 96. Click and you won't be able to access

jonwzheng avatar Oct 04 '23 02:10 jonwzheng

See https://github.com/ReactionMechanismGenerator/RMG-database/issues/641

jonwzheng avatar Mar 18 '24 19:03 jonwzheng

Potential fix in https://github.com/ReactionMechanismGenerator/RMG-database/pull/642

jonwzheng avatar Mar 20 '24 21:03 jonwzheng