You signed in with another tab or window. Reload to refresh your session.You signed out in another tab or window. Reload to refresh your session.You switched accounts on another tab or window. Reload to refresh your session.Dismiss alert
Please add more information to the GOMC manual on NEMTMCFreq and maybe MultiParticleBrownianFreq also.
MultiParticleBrownianFreq is included in the manual. Is there any other options here?
Is NEMTMCFreq done and tested, as it is not in the manual? If so, are there examples? How many options are with it...? What are the allowed combinations and ensembles? What are the default settings.?
This is what I have from my past notes for NEMTMC (not sure if the default settings, or it was the final iteration…)
Please add more information to the GOMC manual on NEMTMCFreq and maybe MultiParticleBrownianFreq also.
MultiParticleBrownianFreq is included in the manual. Is there any other options here?
Is NEMTMCFreq done and tested, as it is not in the manual? If so, are there examples? How many options are with it...? What are the allowed combinations and ensembles? What are the default settings.?
This is what I have from my past notes for NEMTMC (not sure if the default settings, or it was the final iteration…)
NEMTMCFreq 0.20
RelaxingSteps 25
MultiParticleRelaxing true
MultiParticleBrownianRelaxing false
SampleConfFreq 0.15
LambdaVDWLimit 0.1
ScaleAlpha 0.5
MinSigma 3.0
ScaleCoulomb false
The text was updated successfully, but these errors were encountered: