Sorry: It was diago_thr_init. Mahmoud
From: Mpayami via users ([email protected]) Date: 22/04/1402 04:36 To: Quantum ESPRESSO users Forum ([email protected]) Subject: [QE-users] on conv_thr Dear Developers, I noticed that the value of "conv_thr" is set to 1.d-5 when using startingpot='file', irrespective of existing a density file or not. Maybe it would be better it is applied when ther exists a density and code finds it. Otherwise, the code switches to 1.d-2. Isn't it? Bests, Mahmoud Payami NSTRI, AEOI,Tehran, Iran Email: [email protected] Phone: +98(0)2182066504 ------------------------------------ _______________________________________________ The Quantum ESPRESSO community stands by the Ukrainian people and expresses its concerns about the devastating effects that the Russian military offensive has on their country and on the free and peaceful scientific, cultural, and economic cooperation amongst peoples _______________________________________________ Quantum ESPRESSO is supported by MaX (www.max-centre.eu) users mailing list [email protected] https://lists.quantum-espresso.org/mailman/listinfo/users
_______________________________________________ The Quantum ESPRESSO community stands by the Ukrainian people and expresses its concerns about the devastating effects that the Russian military offensive has on their country and on the free and peaceful scientific, cultural, and economic cooperation amongst peoples _______________________________________________ Quantum ESPRESSO is supported by MaX (www.max-centre.eu) users mailing list [email protected] https://lists.quantum-espresso.org/mailman/listinfo/users
