GW calculations over Siesta

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May 15, 2025, 2:30:35 AMMay 15

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Dear All

Our group uses Siesta for band structure calculation.

We need to perform Band structure correction post Siesta (we need to stick to siesta due to our transport calculation requirements)

Can BerkeleyGW code be used for periodic system over Siesta calculations for band structure correction?

It would be great if some workflow (BerkeleyGW+Siesta) for some material (semiconductor/insulator) can be shared with us to start this journey.

Thanks and Regards

Abhishek Sharma

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