Cd Si - Revision history

Karsai: /* Download */

2019-11-14T08:31:35Z

Download

← Older revision		Revision as of 08:31, 14 November 2019
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	== Download ==		== Download ==
	[~~http~~:~~//www.vasp.at/vasp-workshop/examples/diamondSi~~.tgz diamondSi.tgz]		[[Media:DiamondSi.tgz\| diamondSi.tgz]]

	{{Template:Bulk_systems}}		{{Template:Bulk_systems}}

2019-06-07T13:20:38Z

← Older revision		Revision as of 13:20, 7 June 2019
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	{{Template:Bulk_systems}}		{{Template:Bulk_systems - Tutorial}}

	== Task ==		== Task ==

2017-08-10T11:03:40Z

Download

← Older revision		Revision as of 11:03, 10 August 2017
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	== Download ==		== Download ==
	[http://www.vasp.at/vasp-workshop/examples/diamondSi.tgz diamondSi.tgz]		[http://www.vasp.at/vasp-workshop/examples/diamondSi.tgz diamondSi.tgz]
	~~----~~
	~~[[VASP tutorials\|To the list of examples]] or~~ to the [[The_VASP_Manual\|main page]]		{{Template:Bulk_systems}}

			Back to the [[The_VASP_Manual\|main page]].

	[[Category:Examples]]		[[Category:Examples]]

2017-07-04T11:06:36Z

Download

← Older revision		Revision as of 11:06, 4 July 2017
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	[http://www.vasp.at/vasp-workshop/examples/diamondSi.tgz diamondSi.tgz]		[http://www.vasp.at/vasp-workshop/examples/diamondSi.tgz diamondSi.tgz]
	----		----
	[[~~VASP_example_calculations~~\|To the list of examples]] or to the [[The_VASP_Manual\|main page]]		[[VASP tutorials\|To the list of examples]] or to the [[The_VASP_Manual\|main page]]

	[[Category:Examples]]		[[Category:Examples]]

2017-05-12T10:31:42Z

Bandstructure

← Older revision		Revision as of 10:31, 12 May 2017
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	*For "fat" bands (or orbital character of bands) use p4vasp:		*For "fat" bands (or orbital character of bands) use p4vasp:
	~~(figure missing)~~		[[File:Fig cdSi3.png\|800px]]

	'''Mind''': You will have to set the correct path to your VASP executable (i.e., <tt>BIN</tt>), and invoke VASP with the correct command (e.g., in the above: <tt>mpirun -np 2</tt>).		'''Mind''': You will have to set the correct path to your VASP executable (i.e., <tt>BIN</tt>), and invoke VASP with the correct command (e.g., in the above: <tt>mpirun -np 2</tt>).

2017-05-12T10:28:15Z

Bandstructure

← Older revision		Revision as of 10:28, 12 May 2017
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	*The example bandstructure should look like this:		*The example bandstructure should look like this:
	[[File:Fig cdSi 2.png\|~~400px~~]]		[[File:Fig cdSi 2.png\|300px]]

	*For "fat" bands (or orbital character of bands) use p4vasp:		*For "fat" bands (or orbital character of bands) use p4vasp:

2017-05-12T10:27:58Z

Bandstructure

← Older revision		Revision as of 10:27, 12 May 2017
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	*The example bandstructure should look like this:		*The example bandstructure should look like this:
	~~(figure missing)~~		[[File:Fig cdSi 2.png\|400px]]

	*For "fat" bands (or orbital character of bands) use p4vasp:		*For "fat" bands (or orbital character of bands) use p4vasp:

2017-05-12T10:12:44Z

DOS

← Older revision		Revision as of 10:12, 12 May 2017
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	*The example DOS should look like this:		*The example DOS should look like this:
	[[File:Fig cdSi 1.png\|~~600px~~]]		[[File:Fig cdSi 1.png\|300px]]

	=== Bandstructure ===		=== Bandstructure ===

2017-05-12T10:12:35Z

DOS

← Older revision		Revision as of 10:12, 12 May 2017
Line 96:		Line 96:

	*The example DOS should look like this:		*The example DOS should look like this:
	~~(figure missing)~~		[[File:Fig cdSi 1.png\|600px]]

	=== Bandstructure ===		=== Bandstructure ===

2017-05-08T18:45:50Z

← Older revision		Revision as of 18:45, 8 May 2017
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	0.125 0.125 0.125		0.125 0.125 0.125

	*~~Diamond~~ Si starting lattice constant of 5.5 <math>\AA</math>.		*Cubic diamond Si starting lattice constant of 5.5 <math>\AA</math>.
	*Fcc cell.		*Fcc cell.
	*2 atoms in cell.		*2 atoms in cell.