VALUE MIN - Revision history

Huebsch at 14:38, 7 April 2022

2022-04-07T14:38:12Z

← Older revision		Revision as of 14:38, 7 April 2022
Line 1:		Line 1:
	{{DISPLAYTITLE:VALUE_MIN}}		{{DISPLAYTITLE:VALUE_MIN}}{{TAGDEF\|VALUE_MIN\|[real array]}}

	~~{{TAGDEF\|VALUE_MIN\|[real array]}}~~		Description: {{TAG\|VALUE_MIN}} sets the lower limits for the monitoring of geometric parameters (in case VASP was compiled with [[Precompiler options#-Dtbdyn\|-Dtbdyn]]).

	Description: {{TAG\|VALUE_MIN}} sets the lower limits for the monitoring of geometric parameters (in case VASP was compiled with [[~~Precompiler_flags~~\|-Dtbdyn]]).
	----		----
	For {{TAG\|MDALGO}}=1 {{!}} 2, the geometric parameters defined in the {{FILE\|ICONST}}-file may be monitored without being subjected to a constraint or bias potential (<tt>STATUS=7</tt> in the {{FILE\|ICONST}}-file).		For {{TAG\|MDALGO}}=1 {{!}} 2, the geometric parameters defined in the {{FILE\|ICONST}} file may be monitored without being subjected to a constraint or bias potential (<tt>STATUS=7</tt> in the {{FILE\|ICONST}} file).

	If all values of monitored parameters defined in the {{FILE\|ICONST}}-file (<tt>STATUS=7</tt>) are smaller than {{TAG\|VALUE_MIN}} or larger than {{TAG\|VALUE_MAX}}, the simulation terminates.		If all values of monitored parameters defined in the {{FILE\|ICONST}} file (<tt>STATUS=7</tt>) are smaller than {{TAG\|VALUE_MIN}} or larger than {{TAG\|VALUE_MAX}}, the simulation terminates.

	Upper limits for monitored coordinates, must be supplied for each geometric parameter in the {{FILE\|ICONST}}-file with <tt>STATUS=7</tt>.		Upper limits for monitored coordinates, must be supplied for each geometric parameter in the {{FILE\|ICONST}} file with <tt>STATUS=7</tt>.

	== Related tags and articles ==		== Related tags and articles ==
Line 18:		Line 16:
	----		----

	[[Category:INCAR tag]][[Category:Molecular ~~Dynamics~~]]		[[Category:INCAR tag]][[Category:Molecular dynamics]]

Karsai: /* Related tags and articles */

2022-04-07T06:53:39Z

Karsai at 17:05, 6 April 2022

2022-04-06T17:05:40Z

← Older revision		Revision as of 17:05, 6 April 2022
Line 1:		Line 1:
			{{DISPLAYTITLE:VALUE_MIN}}

	{{TAGDEF\|VALUE_MIN\|[real array]}}		{{TAGDEF\|VALUE_MIN\|[real array]}}

Line 9:		Line 11:
	Upper limits for monitored coordinates, must be supplied for each geometric parameter in the {{FILE\|ICONST}}-file with <tt>STATUS=7</tt>.		Upper limits for monitored coordinates, must be supplied for each geometric parameter in the {{FILE\|ICONST}}-file with <tt>STATUS=7</tt>.

	== Related ~~Tags~~ and ~~Sections~~ ==		== Related tags and articles ==
	{{TAG\|VALUE_MAX}},		{{TAG\|VALUE_MAX}},
	{{TAG\|MDALGO}}		{{TAG\|MDALGO}}
Line 16:		Line 18:
	----		----

	[[Category:INCAR]][[Category:Molecular Dynamics]]		[[Category:INCAR tags]][[Category:Molecular Dynamics]]

Karsai at 10:48, 19 April 2019

2019-04-19T10:48:34Z

← Older revision		Revision as of 10:48, 19 April 2019
Line 15:		Line 15:
	{{sc\|VALUE_MIN\|Examples\|Examples that use this tag}}		{{sc\|VALUE_MIN\|Examples\|Examples that use this tag}}
	----		----
	~~[[The_VASP_Manual\|Contents]]~~

	[[Category:INCAR]][[Category:Molecular Dynamics]]		[[Category:INCAR]][[Category:Molecular Dynamics]]

Karsai at 17:24, 15 February 2019

2019-02-15T17:24:43Z

← Older revision		Revision as of 17:24, 15 February 2019
Line 17:		Line 17:
	[[The_VASP_Manual\|Contents]]		[[The_VASP_Manual\|Contents]]

	[[Category:INCAR]][[Category:Dynamics]]		[[Category:INCAR]][[Category:Molecular Dynamics]]

Karsai at 13:15, 20 March 2017

2017-03-20T13:15:43Z

← Older revision		Revision as of 13:15, 20 March 2017
Line 13:		Line 13:
	{{TAG\|MDALGO}}		{{TAG\|MDALGO}}

			{{sc\|VALUE_MIN\|Examples\|Examples that use this tag}}
	----		----
	[[The_VASP_Manual\|Contents]]		[[The_VASP_Manual\|Contents]]

	[[Category:INCAR]][[Category:Dynamics]]		[[Category:INCAR]][[Category:Dynamics]]

Vaspmaster: Created page with '{{TAGDEF|VALUE_MIN|[real array]}} Description: {{TAG|VALUE_MIN}} sets the lower limits for the monitoring of geometric parameters (in case VASP was compiled with [[Precompiler_f…'

2014-04-28T14:02:42Z

Created page with '{{TAGDEF|VALUE_MIN|[real array]}} Description: {{TAG|VALUE_MIN}} sets the lower limits for the monitoring of geometric parameters (in case VASP was compiled with [[Precompiler_f…'

New page

{{TAGDEF|VALUE_MIN|[real array]}}

Description: {{TAG|VALUE_MIN}} sets the lower limits for the monitoring of geometric parameters (in case VASP was compiled with [[Precompiler_flags|-Dtbdyn]]).
----
For {{TAG|MDALGO}}=1 {{!}} 2, the geometric parameters defined in the {{FILE|ICONST}}-file may be monitored without being subjected to a constraint or bias potential (<tt>STATUS=7</tt> in the {{FILE|ICONST}}-file).

If all values of monitored parameters defined in the {{FILE|ICONST}}-file (<tt>STATUS=7</tt>) are smaller than {{TAG|VALUE_MIN}} or larger than {{TAG|VALUE_MAX}}, the simulation terminates.

Upper limits for monitored coordinates, must be supplied for each geometric parameter in the {{FILE|ICONST}}-file with <tt>STATUS=7</tt>.

== Related Tags and Sections ==
{{TAG|VALUE_MAX}},
{{TAG|MDALGO}}

----
[[The_VASP_Manual|Contents]]

[[Category:INCAR]][[Category:Dynamics]]

← Older revision		Revision as of 06:53, 7 April 2022
Line 18:		Line 18:
	----		----

	[[Category:INCAR ~~tags~~]][[Category:Molecular Dynamics]]		[[Category:INCAR tag]][[Category:Molecular Dynamics]]