QuantumATK Forum

QuantumATK => General Questions and Answers => Topic started by: huangshenjie on March 13, 2013, 12:58

Title: a problem about bandstructure
Post by: huangshenjie on March 13, 2013, 12:58

Dear all, I want to calculate the bandstructure of the spin-up and spin-down electrons, respectively. However, in the bandstructure setting, there isn't a parameter of choosing the spin-up electrons~~  Should I set the spin in the initial state??

Title: Re: a problem about bandstructure
Post by: Anders Blom on March 13, 2013, 13:53

The band structure is automatically computed for both spins simultaneously.