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polyamorphism_optimization/polyamorphism_optimization/templates/params/emin.ini

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INI

INTEGRATOR = steep
NSTEPS = 10000
NLOG = 100
NENERGY = 100
NSTXOUT = 100
TAUT = 1.0
TEMP = 300
PCOUPL = no
TCOUPL = no
TAUP = 1.0