Hello The version of PW is different, and the one failing is the newest 🙁 Pietro
________________________________ From: users <users-boun...@lists.quantum-espresso.org> on behalf of Nurit Manukovsky <nurit...@tauex.tau.ac.il> Sent: Thursday, April 3, 2025 14:28 To: Husak Michal via users <users@lists.quantum-espresso.org> Subject: [QE-users] QE crashes with non-local functionals Hello, I am running a simple calculation on two different computer clusters. On one cluster, the calculation is completed successfully. On the other, the calculation is successful when using semi-local functionals, but crashes when using non-local ones. Attached are the output files. I emphasize the input is identical between the two clusters. I am guessing this indicates a difference in the environment QE is run at, but I don't know where to start checking this. I'll appreciate your help. Nurit Manukovsky School of Chemistry, Tel-Aviv University nurit...@tauex.tau.ac.il
_______________________________________________________________________________ The Quantum ESPRESSO Foundation stands in solidarity with all civilians worldwide who are victims of terrorism, military aggression, and indiscriminate warfare. -------------------------------------------------------------------------------- Quantum ESPRESSO is supported by MaX (www.max-centre.eu) users mailing list users@lists.quantum-espresso.org https://lists.quantum-espresso.org/mailman/listinfo/users
