Very good job Thank's a lot
Thank you sir How can I get the software
Assalam o Alaikum, Sir when I do calculations for unscreened hybrid functions then in scf interface it was written that the number of bands in nbands should be an integer and the scf stopped. Though I put 32 bands in nband in case.inhf. sir please help. Thanks SAJID KHAN
Salam alaykom, is DFT-D3 (dispersion correction) taken into account in your SCF calculation using full hybrid functional or i have to mark the box of DFT-D3 (dispersion correction) too?
Hello sir, what should be the hardware requirement in PC to do wien2k calculations in individual level? Kindly suggest. Would core i5 with 4GB RAM and 1 TB be sufficient? Also whether the performance of branded and assembled PC same? Assembled is cheaper for me!
@domel787