Re: [QE-users] ?==?utf-8?q? U calculation, different projection type

2020-08-27 Thread Mona Asadinamin
15-906-23-92 From: users on behalf of Timrov Iurii Sent: Thursday, August 27, 2020 4:01 AM To: Quantum ESPRESSO users Forum Subject: Re: [QE-users] ?==?utf-8?q? U calculation, different projection type [EXTERNAL SENDER - PROCEED CAUTIOUSLY] Dear Mona, > I understand y

Re: [QE-users] ?==?utf-8?q? U calculation, different projection type

2020-08-27 Thread Timrov Iurii
uantum ESPRESSO users Forum Subject: Re: [QE-users] ?==?utf-8?q? U calculation, different projection type [EXTERNAL SENDER - PROCEED CAUTIOUSLY] Dear Antoine, > As the resulting U are drastically different (>1eV), > what is the criterium that we should use to decide wich is the &

Re: [QE-users] ?==?utf-8?q? U calculation, different projection type

2020-08-26 Thread Mona Asadinamin
users Forum Subject: Re: [QE-users] ?==?utf-8?q? U calculation, different projection type [EXTERNAL SENDER - PROCEED CAUTIOUSLY] Dear Antoine, > As the resulting U are drastically different (>1eV), > what is the criterium that we should use to decide wich is the "good"

Re: [QE-users] ?==?utf-8?q? U calculation, different projection type

2020-08-26 Thread Timrov Iurii
Sent: Wednesday, August 26, 2020 11:52:43 AM To: Quantum ESPRESSO users Forum Subject: Re: [QE-users] ?==?utf-8?q? U calculation, different projection type Dear Iurii, As the resulting U are drastically different (>1eV), what is the criterium that we should use to decide wich is the "good"

Re: [QE-users] ?==?utf-8?q? U calculation, different projection type

2020-08-26 Thread Antoine Jay
Dear Iurii, As the resulting U are drastically different (>1eV), what is the criterium that we should use to decide wich is the "good" projector for a given system? Regards, Antoine Jay LAAS-CNRS Toulouse, France Le Mercredi, Août 26, 2020 11:13 CEST, Timrov Iurii a écrit:    Dear Sergey,