v0.4¶
Updated matador dependency PyPI versions > 0.9.
Added
compute_mode="manual"
to just generate structures without relaxingAdded GitHub CI
Rescale cell volume after crossover to maintain density
QoL updates to printing and loading mutations
Allow arbitrary ASE calculator to be used in relaxations
v0.3¶
New keyword:
sandbagging
. When enabled, fitness penalties will be applied to successive sampling of the same region of composition space. By default, the modifier is a multiplicative factor of 0.95 to all compositions within a hypersphere of radius 0.05.compute_mode='slurm'
that makes use of array jobs for “infinite” horizontal scalabilityimproved documentation and examples