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grimme-lab / xtb Public

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Fix metadynamics switchon#803

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susilehtola wants to merge 3 commits into

grimme-lab:maingrimme-lab/xtb:mainfrom

susilehtola:fix_metadynamics_switchonsusilehtola/xtb:fix_metadynamics_switchonCopy head branch name to clipboard

Conversation Commits3 (3)Checks Files changed

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Fix metadynamics switchon#803
susilehtola wants to merge 3 commits into
grimme-lab:mainfrom
susilehtola:fix_metadynamics_switchon

Change default value of ramp from 0.03 to 0.03/4 = 0.075 so that the …

49836ce

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