Dear QE users, I'm here to ask again for your help because I have problems running head.x program.
The program stops with the error: "Error in routine davcio (25): error while writing from file "*/./out/_ph0/*.prd38". I had a similar problem with a calculation on a molecular system and you suggested me to reduce the cutoffs. It worked in that case. Now I have significantly reduce them but I have the same problem. I use Quantum Espresso 5.1 and I work with 64 CPUs. I attach the input files for the pwx calculation and for the head one. Any help will be really appreciated. Thank you very much Valentina Cantatore PostDoc@Università del Piemonte Orientale, Alessandria
MAPbI3_beta_20_100_head.inp
Description: Binary data
MAPbI3_beta_20_100_scf.inp
Description: Binary data
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