QuantumATK Forum
Welcome,
Guest
. Please
login
or
register
.
Did you miss your
activation email
?
1 Hour
1 Day
1 Week
1 Month
Forever
Login with username, password and session length
News:
QuantumATK W-2024.09 version released on Sep 9, 2024
Home
Help
Search
Login
Register
QuantumATK Forum
»
QuantumATK
»
General Questions and Answers
»
Not able to generate the Effective Mass Analyser file
« previous
next »
Print
Pages: [
1
]
Go Down
Author
Topic: Not able to generate the Effective Mass Analyser file (Read 52 times)
0 Members and 1 Guest are viewing this topic.
afv5338
New QuantumATK user
Posts: 1
Country:
Reputation: 0
Not able to generate the Effective Mass Analyser file
«
on:
November 4, 2024, 22:39 »
Hi all,
I'm a new user and trying to follow the tutorials in the documentation. When I tried to generate the effective mass of Si at the lowest part of CB, the script ran without any error, and I got the .py and .log files but not the .hdf5 file for analyzing effective mass (as seen in the image). Any help is greatly appreciated.
Logged
Anders Blom
QuantumATK Staff
Supreme QuantumATK Wizard
Posts: 5569
Country:
Reputation: 93
Re: Not able to generate the Effective Mass Analyser file
«
Reply #1 on:
Today
at 00:19 »
I double-checked the workflow and although it's a bit briefly described, it should be correct and clear. Maybe you forgot to update the filename simply, in which case the effective masses are stored in the original file Si-bandstructure-HSE06.hdf5?
Logged
Print
Pages: [
1
]
Go Up
« previous
next »
QuantumATK Forum
»
QuantumATK
»
General Questions and Answers
»
Not able to generate the Effective Mass Analyser file