#------------------------------------------
# Vampire input file to calculate Ms(T) for 
# Permalloy
#
# (c) R F L Evans 2019
#
#------------------------------------------

#------------------------------------------
# Creation attributes:
#------------------------------------------
create:crystal-structure=fcc
create:periodic-boundaries-x
create:periodic-boundaries-y
create:periodic-boundaries-z
#------------------------------------------
# System Dimensions:
#------------------------------------------
dimensions:unit-cell-size = 3.55 !A
dimensions:system-size-x = 10.0 !nm
dimensions:system-size-y = 10.0 !nm
dimensions:system-size-z = 10.0 !nm
dimensions:particle-size = 10 !nm
#------------------------------------------
# Material Files:
#------------------------------------------
material:file=Py.mat

#------------------------------------------
# Simulation attributes:
#------------------------------------------
sim:minimum-temperature = 0
sim:maximum-temperature = 1000
sim:temperature-increment = 10
sim:time-steps-increment=1
sim:equilibration-time-steps=5000
sim:loop-time-steps = 15000

#------------------------------------------
# Program and integrator details
#------------------------------------------
sim:program=curie-temperature
sim:integrator=monte-carlo

#------------------------------------------
# data output
#------------------------------------------
output:real-time
output:temperature
output:material-magnetisation
output:material-mean-magnetisation-length
output:mean-susceptibility
output:material-mean-susceptibility
output:mean-specific-heat
output:material-mean-specific-heat
