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im trying to study an isolated atom(Boron) and i can't for the life of me figure out what to do with the total magnetisation, which is defined as :
cheers
mechdude
further more:quantum_espresso said:total majority spin charge - minority spin charge.
what are these guys talking about? is this explained out in detail somewhere in ENGLISH for humans?quantum_espresso said:Used to impose a specific total electronic magnetization.
cheers
mechdude