[QE-users] Orbital magnetization and GIPAW

Malte Sachs malte.sachs at chemie.uni-marburg.de
Wed Sep 23 19:55:18 CEST 2020


Dear all,

I have found a paper (PHYSICAL REVIEW B 81, 060409R 2010) in which 
the orbital magnetization of Fe,Co and Ni is calculated by the GIPAW 
method. The authors mention that the method is implemented in Quantum 
Espresso. However, I do not find any hint in the Quantum Espresso 
distribution or at the GIPAW code. Can anybody tell me, where to find 
this code or if it available at all?

Thank you and best regards,

Malte

-- 
Malte Sachs
Anorganische Chemie, Fluorchemie
Philipps-Universität Marburg
Hans-Meerwein-Straße 4
35032 Marburg (Paketpost: 35043 Marburg)
Tel.: +49 (0)6421 28 - 25 68 0
http://www.uni-marburg.de/fb15/ag-kraus/


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