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MoS2 orientation for band structure
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Topic: MoS2 orientation for band structure (Read 3653 times)
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Manish95
Heavy QuantumATK user
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MoS2 orientation for band structure
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on:
September 3, 2018, 15:50 »
If i am doing only band structure calculation, is it necessary to align the z direction in MoS2 plane?
I am referring to step 3 in Geometry for MoS2,
https://docs.quantumwise.com/tutorials/transmission_gr_mos2/transmission_gr_mos2.html
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Petr Khomyakov
QuantumATK Staff
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Re: MoS2 orientation for band structure
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Reply #1 on:
September 4, 2018, 10:50 »
For band structure calculations, it is not necessary.
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MoS2 orientation for band structure