ELPH SELFEN CARRIER DEN - Revision history

Singraber at 08:07, 24 October 2025

2025-10-24T08:07:27Z

← Older revision		Revision as of 08:07, 24 October 2025
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	{{NB\|important\|The {{TAG\|ELPH_SELFEN_CARRIER_DEN}} adds electrons when positive, i.e., ''n''-doping; when negative, {{TAG\|ELPH_SELFEN_CARRIER_DEN}} removes electrons from the system, i.e., ''p''-doping.}}		{{NB\|important\|The {{TAG\|ELPH_SELFEN_CARRIER_DEN}} adds electrons when positive, i.e., ''n''-doping; when negative, {{TAG\|ELPH_SELFEN_CARRIER_DEN}} removes electrons from the system, i.e., ''p''-doping.}}

	For example, if {{~~TAGO~~\|ELPH_SELFEN_CARRIER_DEN\|1e+16 1e+17 1e+18}} the <tt>Chemical potential</tt> section in the {{FILE\|OUTCAR}} file might show something like		For example, if {{TAG\|ELPH_SELFEN_CARRIER_DEN\|1e+16 1e+17 1e+18}} the <tt>Chemical potential</tt> section in the {{FILE\|OUTCAR}} file might show something like

	Number of electrons per cell		Number of electrons per cell

Csheldon: /* Related tags and articles */

2025-10-21T10:37:38Z

Csheldon at 08:48, 20 October 2025

2025-10-20T08:48:10Z

← Older revision		Revision as of 08:48, 20 October 2025
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	* [[Transport coefficients including electron-phonon scattering\|Transport calculations]]		* [[Transport coefficients including electron-phonon scattering\|Transport calculations]]
	* [[Electron-phonon accumulators]]		* [[Electron-phonon accumulators]]
			* [[Chemical potential]]
	* {{TAG\|ELPH_RUN}}		* {{TAG\|ELPH_RUN}}
	* {{TAG\|ELPH_SELFEN_CARRIER_DEN_RANGE}}		* {{TAG\|ELPH_SELFEN_CARRIER_DEN_RANGE}}

Csheldon at 14:26, 17 October 2025

2025-10-17T14:26:01Z

← Older revision		Revision as of 14:26, 17 October 2025
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	* [[Electron-phonon accumulators]]		* [[Electron-phonon accumulators]]
	* {{TAG\|ELPH_RUN}}		* {{TAG\|ELPH_RUN}}
			* {{TAG\|ELPH_SELFEN_CARRIER_DEN_RANGE}}
	* {{TAG\|ELPH_SELFEN_CARRIER_PER_CELL}}		* {{TAG\|ELPH_SELFEN_CARRIER_PER_CELL}}
	* {{TAG\|ELPH_SELFEN_TEMPS}}		* {{TAG\|ELPH_SELFEN_TEMPS}}

Csheldon at 14:32, 15 October 2025

2025-10-15T14:32:40Z

← Older revision		Revision as of 14:32, 15 October 2025
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	Specifying more than one carrier density in {{TAG\|ELPH_SELFEN_CARRIER_DEN}} creates additional [[Electron-phonon accumulators \| electron-phonon accumulators]].		Specifying more than one carrier density in {{TAG\|ELPH_SELFEN_CARRIER_DEN}} creates additional [[Electron-phonon accumulators \| electron-phonon accumulators]].

	Instead of specifying a carrier density, it is possible to explicitly specify the additional number of electrons to be added by using the {{TAG\|ELPH_SELFEN_CARRIER_PER_CELL}} tag. You can also express the number of electrons in a range using {{TAG\|ELPH_SELFEN_CARRIER_DEN_RANGE}}. Alternatively, one can specify the chemical potential directly and determine the carrier concentration using {{TAG\|ELPH_SELFEN_MU}}.		Instead of specifying a carrier density, it is possible to explicitly specify the additional number of electrons to be added by using the {{TAG\|ELPH_SELFEN_CARRIER_PER_CELL}} tag.<!-- You can also express the number of electrons in a range using {{TAG\|ELPH_SELFEN_CARRIER_DEN_RANGE}}.--> Alternatively, one can specify the chemical potential directly and determine the carrier concentration using {{TAG\|ELPH_SELFEN_MU}}.

	The information related to the chemical potential calculation can be found under the <tt>Chemical potential calculation</tt> section in the {{FILE\|OUTCAR}}.		The information related to the chemical potential calculation can be found under the <tt>Chemical potential calculation</tt> section in the {{FILE\|OUTCAR}}.

Csheldon: /* Related tags and articles */

2025-10-15T13:36:57Z

Csheldon at 08:55, 15 October 2025

2025-10-15T08:55:44Z

← Older revision		Revision as of 08:55, 15 October 2025
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	Specifying more than one carrier density in {{TAG\|ELPH_SELFEN_CARRIER_DEN}} creates additional [[Electron-phonon accumulators \| electron-phonon accumulators]].		Specifying more than one carrier density in {{TAG\|ELPH_SELFEN_CARRIER_DEN}} creates additional [[Electron-phonon accumulators \| electron-phonon accumulators]].

	Instead of specifying a carrier density, it is possible to explicitly specify the additional number of electrons to be added by using the {{TAG\|ELPH_SELFEN_CARRIER_PER_CELL}} tag. Alternatively, one can specify the chemical potential directly and determine the carrier concentration using {{TAG\|ELPH_SELFEN_MU}}.		Instead of specifying a carrier density, it is possible to explicitly specify the additional number of electrons to be added by using the {{TAG\|ELPH_SELFEN_CARRIER_PER_CELL}} tag. You can also express the number of electrons in a range using {{TAG\|ELPH_SELFEN_CARRIER_DEN_RANGE}}. Alternatively, one can specify the chemical potential directly and determine the carrier concentration using {{TAG\|ELPH_SELFEN_MU}}.

	The information related to the chemical potential calculation can be found under the <tt>Chemical potential calculation</tt> section in the {{FILE\|OUTCAR}}.		The information related to the chemical potential calculation can be found under the <tt>Chemical potential calculation</tt> section in the {{FILE\|OUTCAR}}.
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	* {{TAG\|ELPH_RUN}}		* {{TAG\|ELPH_RUN}}
	* {{TAG\|ELPH_SELFEN_CARRIER_PER_CELL}}		* {{TAG\|ELPH_SELFEN_CARRIER_PER_CELL}}
			* {{TAG\|ELPH_SELFEN_CARRIER_DEN_RANGE}}
			* {{TAG\|ELPH_SELFEN_TEMPS}}
			* {{TAG\|ELPH_SELFEN_TEMPS_RANGE}}
	* {{TAG\|ELPH_SELFEN_MU}}		* {{TAG\|ELPH_SELFEN_MU}}
	* {{TAG\|~~ELPH_SELFEN_TEMPS~~}}		* {{TAG\|ELPH_SELFEN_MU_RANGE}}
	* {{TAG\|NELECT}}		* {{TAG\|NELECT}}

	[[Category:INCAR tag]][[Category:Electron-phonon_interactions]]		[[Category:INCAR tag]][[Category:Electron-phonon_interactions]]

Miranda.henrique at 14:36, 9 October 2025

2025-10-09T14:36:01Z

← Older revision		Revision as of 14:36, 9 October 2025
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	From each carrier density specified in the array, a positive (electron doping) or negative (hole doping) number of electrons is added to the value of {{TAG\|NELECT}} and the chemical potential computed for the list of temperatures specified by {{TAG\|ELPH_SELFEN_TEMPS}}.		From each carrier density specified in the array, a positive (electron doping) or negative (hole doping) number of electrons is added to the value of {{TAG\|NELECT}} and the chemical potential computed for the list of temperatures specified by {{TAG\|ELPH_SELFEN_TEMPS}}.
			{{NB\|important\|The {{TAG\|ELPH_SELFEN_CARRIER_DEN}} adds electrons when positive, i.e., ''n''-doping; when negative, {{TAG\|ELPH_SELFEN_CARRIER_DEN}} removes electrons from the system, i.e., ''p''-doping.}}

	For example, if {{TAGO\|ELPH_SELFEN_CARRIER_DEN\|1e+16 1e+17 1e+18}} the <tt>Chemical potential</tt> section in the {{FILE\|OUTCAR}} file might show something like		For example, if {{TAGO\|ELPH_SELFEN_CARRIER_DEN\|1e+16 1e+17 1e+18}} the <tt>Chemical potential</tt> section in the {{FILE\|OUTCAR}} file might show something like

Miranda.henrique at 06:55, 24 April 2025

2025-04-24T06:55:35Z

← Older revision		Revision as of 06:55, 24 April 2025
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	{{TAGDEF\|ELPH_SELFEN_CARRIER_DEN\|[real array]\|0.0}}		{{TAGDEF\|ELPH_SELFEN_CARRIER_DEN\|[real array]\|0.0}}

	Description: List of additional carrier densities in units of <math>m^{-3}</math> at which to compute the phonon-mediated electron self-energy and transport coefficients.		Description: List of additional carrier densities in units of <math>cm^{-3}</math> at which to compute the phonon-mediated electron self-energy and transport coefficients.
	{{Available\|6.5.0}}		{{Available\|6.5.0}}

Mani: Add accumulator links

2025-02-28T08:25:56Z

Add accumulator links

← Older revision		Revision as of 08:25, 28 February 2025
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	{{TAGDEF\|ELPH_SELFEN_CARRIER_DEN\|[real array]\|0.0}}		{{TAGDEF\|ELPH_SELFEN_CARRIER_DEN\|[real array]\|0.0}}

	Description: List of additional carrier densities in units of <math>m^{-3}</math> at which to compute the electron~~-phonon~~ self-energy and transport coefficients.		Description: List of additional carrier densities in units of <math>m^{-3}</math> at which to compute the phonon-mediated electron self-energy and transport coefficients.
	{{Available\|6.5.0}}		{{Available\|6.5.0}}

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	----------------------------		----------------------------

	~~The~~ number of elements in {{TAG\|ELPH_SELFEN_CARRIER_DEN}} determines the number of columns, the number of elements in {{TAG\|ELPH_SELFEN_TEMPS}} the number of rows in ~~the tables above~~.		In the above tables, the number of elements in {{TAG\|ELPH_SELFEN_CARRIER_DEN}} determines the number of columns, while the number of elements in {{TAG\|ELPH_SELFEN_TEMPS}} determines the number of rows.
			Specifying more than one carrier density in {{TAG\|ELPH_SELFEN_CARRIER_DEN}} creates additional [[Electron-phonon accumulators \| electron-phonon accumulators]].

	Instead of specifying a carrier density, it is possible to explicitly specify the additional number of electrons to be added by using the {{TAG\|ELPH_SELFEN_CARRIER_PER_CELL}} tag. Alternatively, one can specify the chemical potential directly and determine the carrier concentration using {{TAG\|ELPH_SELFEN_MU}}.		Instead of specifying a carrier density, it is possible to explicitly specify the additional number of electrons to be added by using the {{TAG\|ELPH_SELFEN_CARRIER_PER_CELL}} tag. Alternatively, one can specify the chemical potential directly and determine the carrier concentration using {{TAG\|ELPH_SELFEN_MU}}.
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	==Related tags and articles==		==Related tags and articles==
	* [[Transport coefficients including electron-phonon scattering\|Transport calculations]]		* [[Transport coefficients including electron-phonon scattering\|Transport calculations]]
			* [[Electron-phonon accumulators]]
	* {{TAG\|ELPH_RUN}}		* {{TAG\|ELPH_RUN}}
	* {{TAG\|ELPH_SELFEN_CARRIER_PER_CELL}}		* {{TAG\|ELPH_SELFEN_CARRIER_PER_CELL}}

← Older revision		Revision as of 10:37, 21 October 2025
Line 41:		Line 41:
	* [[Transport coefficients including electron-phonon scattering\|Transport calculations]]		* [[Transport coefficients including electron-phonon scattering\|Transport calculations]]
	* [[Electron-phonon accumulators]]		* [[Electron-phonon accumulators]]
	* [[Chemical potential]]		* [[Chemical potential in electron-phonon interactions]]
	* {{TAG\|ELPH_RUN}}		* {{TAG\|ELPH_RUN}}
	* {{TAG\|ELPH_SELFEN_CARRIER_DEN_RANGE}}		* {{TAG\|ELPH_SELFEN_CARRIER_DEN_RANGE}}

← Older revision		Revision as of 14:26, 17 October 2025
Line 42:		Line 42:
	* [[Electron-phonon accumulators]]		* [[Electron-phonon accumulators]]
	* {{TAG\|ELPH_RUN}}		* {{TAG\|ELPH_RUN}}
			* {{TAG\|ELPH_SELFEN_CARRIER_DEN_RANGE}}
	* {{TAG\|ELPH_SELFEN_CARRIER_PER_CELL}}		* {{TAG\|ELPH_SELFEN_CARRIER_PER_CELL}}
	* {{TAG\|ELPH_SELFEN_TEMPS}}		* {{TAG\|ELPH_SELFEN_TEMPS}}

← Older revision		Revision as of 14:32, 15 October 2025
Line 34:		Line 34:
	Specifying more than one carrier density in {{TAG\|ELPH_SELFEN_CARRIER_DEN}} creates additional [[Electron-phonon accumulators \| electron-phonon accumulators]].		Specifying more than one carrier density in {{TAG\|ELPH_SELFEN_CARRIER_DEN}} creates additional [[Electron-phonon accumulators \| electron-phonon accumulators]].

	Instead of specifying a carrier density, it is possible to explicitly specify the additional number of electrons to be added by using the {{TAG\|ELPH_SELFEN_CARRIER_PER_CELL}} tag. You can also express the number of electrons in a range using {{TAG\|ELPH_SELFEN_CARRIER_DEN_RANGE}}. Alternatively, one can specify the chemical potential directly and determine the carrier concentration using {{TAG\|ELPH_SELFEN_MU}}.		Instead of specifying a carrier density, it is possible to explicitly specify the additional number of electrons to be added by using the {{TAG\|ELPH_SELFEN_CARRIER_PER_CELL}} tag.<!-- You can also express the number of electrons in a range using {{TAG\|ELPH_SELFEN_CARRIER_DEN_RANGE}}.--> Alternatively, one can specify the chemical potential directly and determine the carrier concentration using {{TAG\|ELPH_SELFEN_MU}}.

	The information related to the chemical potential calculation can be found under the <tt>Chemical potential calculation</tt> section in the {{FILE\|OUTCAR}}.		The information related to the chemical potential calculation can be found under the <tt>Chemical potential calculation</tt> section in the {{FILE\|OUTCAR}}.

← Older revision		Revision as of 13:36, 15 October 2025
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	* {{TAG\|ELPH_RUN}}		* {{TAG\|ELPH_RUN}}
	* {{TAG\|ELPH_SELFEN_CARRIER_PER_CELL}}		* {{TAG\|ELPH_SELFEN_CARRIER_PER_CELL}}
	* {{TAG\|ELPH_SELFEN_CARRIER_DEN_RANGE}}
	* {{TAG\|ELPH_SELFEN_TEMPS}}		* {{TAG\|ELPH_SELFEN_TEMPS}}
	* {{TAG\|ELPH_SELFEN_TEMPS_RANGE}}		* {{TAG\|ELPH_SELFEN_TEMPS_RANGE}}

← Older revision		Revision as of 08:55, 15 October 2025
Line 34:		Line 34:
	Specifying more than one carrier density in {{TAG\|ELPH_SELFEN_CARRIER_DEN}} creates additional [[Electron-phonon accumulators \| electron-phonon accumulators]].		Specifying more than one carrier density in {{TAG\|ELPH_SELFEN_CARRIER_DEN}} creates additional [[Electron-phonon accumulators \| electron-phonon accumulators]].

	Instead of specifying a carrier density, it is possible to explicitly specify the additional number of electrons to be added by using the {{TAG\|ELPH_SELFEN_CARRIER_PER_CELL}} tag. Alternatively, one can specify the chemical potential directly and determine the carrier concentration using {{TAG\|ELPH_SELFEN_MU}}.		Instead of specifying a carrier density, it is possible to explicitly specify the additional number of electrons to be added by using the {{TAG\|ELPH_SELFEN_CARRIER_PER_CELL}} tag. You can also express the number of electrons in a range using {{TAG\|ELPH_SELFEN_CARRIER_DEN_RANGE}}. Alternatively, one can specify the chemical potential directly and determine the carrier concentration using {{TAG\|ELPH_SELFEN_MU}}.

	The information related to the chemical potential calculation can be found under the <tt>Chemical potential calculation</tt> section in the {{FILE\|OUTCAR}}.		The information related to the chemical potential calculation can be found under the <tt>Chemical potential calculation</tt> section in the {{FILE\|OUTCAR}}.
Line 43:		Line 43:
	* {{TAG\|ELPH_RUN}}		* {{TAG\|ELPH_RUN}}
	* {{TAG\|ELPH_SELFEN_CARRIER_PER_CELL}}		* {{TAG\|ELPH_SELFEN_CARRIER_PER_CELL}}
			* {{TAG\|ELPH_SELFEN_CARRIER_DEN_RANGE}}
			* {{TAG\|ELPH_SELFEN_TEMPS}}
			* {{TAG\|ELPH_SELFEN_TEMPS_RANGE}}
	* {{TAG\|ELPH_SELFEN_MU}}		* {{TAG\|ELPH_SELFEN_MU}}
	* {{TAG\|~~ELPH_SELFEN_TEMPS~~}}		* {{TAG\|ELPH_SELFEN_MU_RANGE}}
	* {{TAG\|NELECT}}		* {{TAG\|NELECT}}

	[[Category:INCAR tag]][[Category:Electron-phonon_interactions]]		[[Category:INCAR tag]][[Category:Electron-phonon_interactions]]