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General Questions and Answers / Re: Bandstructure
« on: November 27, 2018, 16:28 »
Thank u sir
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General Questions and Answers / Re: Bandstructure
« on: November 26, 2018, 10:20 »
Yes Sir, I'm doing these calculations for the heterostructure.
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General Questions and Answers / Re: Bandstructure
« on: November 24, 2018, 07:33 »
Hello
I have attach the file of band structure. In this it has only straight lines, is it possible that this type of band structure comes of hetero-structure?
I have attach the file of band structure. In this it has only straight lines, is it possible that this type of band structure comes of hetero-structure?
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General Questions and Answers / Bandstructure
« on: November 22, 2018, 05:45 »
Hello
If band-structure has only straight lines by some brillouin zone. Is it correct or not?
but if i am using another brillouin zone then it comes zero band-gap.
If band-structure has only straight lines by some brillouin zone. Is it correct or not?
but if i am using another brillouin zone then it comes zero band-gap.
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General Questions and Answers / Heterostructure
« on: September 1, 2018, 14:07 »
Is it possible to make a hetero-structure between HgCdTe and monolayer MoS2?
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General Questions and Answers / Re: ternary alloy
« on: September 1, 2018, 08:13 »
I have found my mistake.
Thank you...
Thank you...
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General Questions and Answers / Re: c parameter
« on: August 23, 2018, 11:09 »
thank you sir again
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General Questions and Answers / ternary alloy
« on: August 23, 2018, 08:23 »
I have tried to make a compound Hg(1-x)Cd(x)Te. I have take first HgTe then by selecting Hg atoms replace with Cd atoms by substitutional alloy option in builders ( Normal distribution). Then repeat this in all three directions.
Send to the script generator add new calculator and from analysis block add band structure. But problem is that it shows 0ev band gap. I have take reference from tutorial of InGaAs.
Send to the script generator add new calculator and from analysis block add band structure. But problem is that it shows 0ev band gap. I have take reference from tutorial of InGaAs.
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General Questions and Answers / Re: c parameter
« on: August 22, 2018, 19:36 »
Is it always necessary to enter c parameter in the editor or without it we can find results?
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General Questions and Answers / Re: c parameter
« on: August 21, 2018, 11:55 »
Thank you very much...
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General Questions and Answers / c parameter
« on: August 19, 2018, 08:00 »
How to calculate MGGA c parameter?
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