pele.storage.savenlowest

Module source

Created on Apr 18, 2012

@author: vr274

class pele.storage.savenlowest.Minimum

Source

class Minimum:

class for storing minima

class pele.storage.savenlowest.SaveN

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class SaveN:

Stores only the nsave lowest minima. Minima are considered as different if energy differs by more than accuracy

SaveN.__init__()

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def __init__(
    self,
    nsave=1,
    accuracy=1e-3,
    onMinimumAdded=None,
    onMinimumRemoved=None,
    compareMinima=None,
):

Constructor