Re: [QE-users] turbo_eels.x results

2022-05-20 Thread Elio Physics
Dear Iurri, Thank you very much for your detailed response. Elie From: users on behalf of Iurii TIMROV via users Sent: Friday, May 20, 2022 6:16 AM To: Quantum Espresso users Forum Subject: Re: [QE-users] turbo_eels.x results > My question is How woul

Re: [QE-users] turbo_eels.x results

2022-05-20 Thread Iurii TIMROV via users
ch/265334 From: users on behalf of Elio Physics Sent: Thursday, May 19, 2022 7:48:43 PM To: Quantum Espresso users Forum Subject: [QE-users] turbo_eels.x results Dear QE users, I am performing some absorption calculations using the turbo_eels.x and turbo_spect

[QE-users] turbo_eels.x results

2022-05-19 Thread Elio Physics
Dear QE users, I am performing some absorption calculations using the turbo_eels.x and turbo_spectrum.x executables at q1=0.0001, q2=0.0, q3=0.0, as is advised by the developers of these toolsets. The reason I am not using the tubo_lanczos.x is because I am not using a supercell and I have inc