Ni 100 surface bandstructure - Revision history

Karsai: /* Download */

2019-11-14T13:55:13Z

Download

← Older revision		Revision as of 13:55, 14 November 2019
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	{{Sur_sci}}		{{Sur_sci}}

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

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

2019-11-14T09:53:58Z

Download

← Older revision		Revision as of 09:53, 14 November 2019
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	== Download ==		== Download ==
	[~~http~~:~~//www.vasp.at/vasp-workshop/examples/~~Ni100clean_band.tgz Ni100clean_band.tgz]		[[Media:Ni100clean_band.tgz\| Ni100clean_band.tgz]]

	{{Sur_sci}}		{{Sur_sci}}

2019-06-23T18:43:25Z

Calculation

← Older revision		Revision as of 18:43, 23 June 2019
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	*The bandstructure can be plotted using p4vasp:		*The bandstructure can be plotted using p4vasp:
	[[File:Fig Ni 100 surfband 3.png\|800px]]		[[File:Fig Ni 100 surfband 3.png\|800px]]
			<!--
	*The example output for the projected bandstructure consists mainly out of bulk like bands. The Yelllow dots mark the surface loclizations:		*The example output for the projected bandstructure consists mainly out of bulk like bands. The Yelllow dots mark the surface loclizations:
	[[File:Fig Ni 100 surfband 2.png\|300px]]		[[File:Fig Ni 100 surfband 2.png\|300px]]
			-->

	== Download ==		== Download ==

2019-06-07T13:35:35Z

2017-08-10T11:15:38Z

Download

← Older revision		Revision as of 11:15, 10 August 2017
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	== Download ==		== Download ==
	[http://www.vasp.at/vasp-workshop/examples/Ni100clean_band.tgz Ni100clean_band.tgz]		[http://www.vasp.at/vasp-workshop/examples/Ni100clean_band.tgz Ni100clean_band.tgz]
	~~----~~
	~~[[VASP tutorials\|To the list of examples]] or~~ to the [[The_VASP_Manual\|main page]]		{{Sur_sci}}

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

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

2017-07-04T11:14:29Z

Download

← Older revision		Revision as of 11:14, 4 July 2017
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	[http://www.vasp.at/vasp-workshop/examples/Ni100clean_band.tgz Ni100clean_band.tgz]		[http://www.vasp.at/vasp-workshop/examples/Ni100clean_band.tgz Ni100clean_band.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]]

2017-05-15T14:20:49Z

Calculation

← Older revision		Revision as of 14:20, 15 May 2017
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	*The bandstructure can be plotted using p4vasp:		*The bandstructure can be plotted using p4vasp:
	[[File:Fig Ni 100 surfband 3.png\|~~600px~~]]		[[File:Fig Ni 100 surfband 3.png\|800px]]

	*The example output for the projected bandstructure consists mainly out of bulk like bands. The Yelllow dots mark the surface loclizations:		*The example output for the projected bandstructure consists mainly out of bulk like bands. The Yelllow dots mark the surface loclizations:
	[[File:Fig Ni 100 surfband 2.png\|~~400px~~]]		[[File:Fig Ni 100 surfband 2.png\|300px]]

	== Download ==		== Download ==

2017-05-15T14:20:35Z

Calculation

← Older revision		Revision as of 14:20, 15 May 2017
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	== Calculation ==		== Calculation ==

	*The example output for the bandstructure ~~should look as follows~~:		*In the {{TAG\|OUTCAR}} file the status message on the actual job (non-selfconsistent calculation) is given:
			...
			Static calculation
			charge density remains constant during run
			spin polarized calculation
			...

			*The bandstructure can be plotted using p4vasp:
			[[File:Fig Ni 100 surfband 3.png\|600px]]

			*The example output for the projected bandstructure consists mainly out of bulk like bands. The Yelllow dots mark the surface loclizations:
	[[File:Fig Ni 100 surfband 2.png\|400px]]		[[File:Fig Ni 100 surfband 2.png\|400px]]

2017-05-15T14:16:19Z

Calculation

← Older revision		Revision as of 14:16, 15 May 2017
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	== Calculation ==		== Calculation ==

			*The example output for the bandstructure should look as follows:
			[[File:Fig Ni 100 surfband 2.png\|400px]]

	== Download ==		== Download ==

2017-05-15T14:14:42Z

← Older revision		Revision as of 14:14, 15 May 2017
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	</pre>		</pre>

	[[File:Fig Ni 100 surfband 1.png\|~~400px~~]]		[[File:Fig Ni 100 surfband 1.png\|200px]]
	*13 k points along line <math>\Gamma - X - M - \Gamma</math>.		*13 k points along line <math>\Gamma - X - M - \Gamma</math>.
	*The coordinates are given in reciprocal coordinates.		*The coordinates are given in reciprocal coordinates.