FREE_ORBS ?

[Sharma_Omprakash]

How do I use 'FREE_ORBS' block in correlation.data file to write linear combination of plane-wave and polynomial pairing orbital?
I have used START PAIRING ... END PAIRING block (as mentioned in the manual) in the correlation.data file but when I run it an error encountered "ERROR: Unknown block PAIRING in ..../Home/... " .

[Mike Towler]

Hi Sharma,

Can you send the correlation.data file you're using..

Mike

[Sharma_Omprakash]

Dear Sir,
Thank you for reply. Here I have attached the correlation.data and input file that is created to study the fluid phase of the electron-hole bi-layer quantum system as a beginner.

[Mike Towler]

I believe you need to embed your START/END PAIRING block inside the following structure:

START FREE_ORBS

END FREE_ORBS

Looking at the documentation, this isn't as obvious as it should be. I'll get that updated.

Cheers,
Mike

[Sharma_Omprakash]

Thank you Sir. It fixed the error.