QuantumATK Forum

QuantumATK => General Questions and Answers => Topic started by: zhangguangping on April 3, 2011, 06:11

Title: Again for the MPSH implemented in 2008.10
Post by: zhangguangping on April 3, 2011, 06:11

Dear all,

I wonder at what k point does the MPSH in 2008.10 is calculated.

Is it calculated at Gamma point or an average over all the K points used in the calculation.

I think it is calculated at the Gamma point, if it is average over the K points, it has non sense or how to average?

Any advice is welcome.

Best.

Title: Re: Again for the MPSH implemented in 2008.10
Post by: Anders Blom on April 3, 2011, 23:25

Yes, Gamma point.

Title: Re: Again for the MPSH implemented in 2008.10
Post by: zhangguangping on April 4, 2011, 01:50

Quote from: Anders Blom on April  3, 2011, 23:25

Yes, Gamma point.

Thanks for your kindly reply.

Best.