[QE-users] turbo_lanczos input file

[Timrov Iurii]

Dear Karem,

With turbo_lanczos.x you can compute an absorption spectrum. Then by looking at the spectrum, you choose a peak of interest, and its position would be your omeg.

HTH

Regards,
Iurii

--
Dr. Iurii Timrov
Postdoctoral Researcher
STI - IMX - THEOS and NCCR - MARVEL
Swiss Federal Institute of Technology Lausanne (EPFL)
CH-1015 Lausanne, Switzerland
+41 21 69 34 881
http://people.epfl.ch/265334
________________________________
From: users <users-bounces at lists.quantum-espresso.org> on behalf of kazem zhour <kazem.zhour at hotmail.com>
Sent: Thursday, September 19, 2019 11:35:50 AM
To: users at lists.quantum-espresso.org
Subject: [QE-users] turbo_lanczos input file

I'm studying the plasmonic properties of Borophene decorated with some metals. I'm using turbo_lanczos.x to calculate the absorption spectrum. I need to determine the parameter "omeg" which represent transition energy in Ry as mentioned on the
reference of turboTDDFT calculations and the Input file. Does it depend on the structure that I'm working with? and how can I find its value exactly?

Kazem Zhour
PhD student
University of Santiago de compostela

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