typo

[azam cheraghi]

Hi,

I am trying to do NPT using BoxMC updater, but I don't know much about notation. The following code is wrong in notation, but don't know how to fix.

hoomd.hpmc.update.BoxMC(trigger=hoomd.trigger.Periodic(10), betaP = 20, volume.mode == 'standard', volume.weight = 0.5, volume.delta = 5)

 I would really appreciate if you could help me.

Thanks 

Azam

[Brandon Butler]

Azam,

As the documetation states, volume is a dict attribute so try

boxmc = hoomd.hpmc.update.BoxMC(trigger=10, betaP=20)

boxmc.volume = {"mode": "standard", "weight": 0.5, "delta": 5.0)

Best,

Brandon

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Brandon Butler
MolSSI Fellow
PhD Candidate, Chemical Engineering and Scientific Computing | Glotzer Lab, University of Michigan
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[azam cheraghi]

Perfect, I am not familiar with the notations yet. Thanks alot for your help.

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