Difference between revisions of "Eph Tinfile"

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(Created page with "<code>eph_Tinfile</code> takes the name of the file the parameters to construct the mesh in three dimensions for the electronic system. If this file is provided, then the corr...")
 
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  i j k T_e S_e rho_e C_e K_e flag T_dyn_flag
 
  i j k T_e S_e rho_e C_e K_e flag T_dyn_flag
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  1 1 1 50.0 1.0 1.0 3.5E-07 0.12 0 0
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=== Summary ===
 
=== Summary ===
  
 
{| class="wikitable"
 
{| class="wikitable"
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|+ Summary for <code>eph_betafile</code> keyword
+
|+ Summary for <code>eph_Tinfile</code> keyword
 
! style="text-align:left;"| Required/optional
 
! style="text-align:left;"| Required/optional
 
! style="text-align:left;"| Type
 
! style="text-align:left;"| Type
Line 44: Line 44:
 
! style="text-align:left;"| Remarks
 
! style="text-align:left;"| Remarks
 
|-
 
|-
−
| Required
+
| Optional
 
| String
 
| String
 
| Short file names
 
| Short file names
 
| 'NULL'
 
| 'NULL'
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| <code>[[electronic_stopping]]</code>, <code>[[estop_filename]]</code>, <code>[[nonadiabatic_processes]]</code>
+
| <code>[[nonadiabatic_processes]]</code>
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| A coupling parameter file must be provided.
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| If this file is not provided the FDM mesh is constructed from given input data.
 
|}
 
|}

Revision as of 13:03, 27 September 2023

eph_Tinfile takes the name of the file the parameters to construct the mesh in three dimensions for the electronic system. If this file is provided, then the corresponding electronic parameters need not be provided in input file as those will not be considered. This file has to be prepared in a standard format. This is shown below. 

1st line – any comments
2nd line – any comments
3rd line – any comments
4th line – gsx gsy gsz number_of_fdm_steps
5th line – mesh_xlimit_low mesh_xlimit_high
6th line – mesh_ylimit_low mesh_ylimit_high
7th line – mesh_zlimit_low mesh_zlimit_high
8th line – i j k T_e S_e rho_e C_e K_e flag T_dyn_flag
9th line – values corresponding to column headers
10th line – values corresponding to column headers
….
….
Values are provided for the full mesh.

Example
#
# 3 lines of comments
#
2 2 2 1
-30.0 30.0
-30.0 30.0
-30.0 30.0
i j k T_e S_e rho_e C_e K_e flag T_dyn_flag
1 1 1 50.0 1.0 1.0 3.5E-01 0.12 0 0
2 1 1 50.0 1.0 1.0 3.5E-01 0.12 0 0
1 2 1 50.0 1.0 1.0 3.5E-01 0.12 0 0
2 2 1 50.0 1.0 1.0 3.5E-01 0.12 0 0
1 1 2 50.0 1.0 1.0 3.5E-01 0.12 0 0
2 1 2 50.0 1.0 1.0 3.5E-01 0.12 0 0
1 2 2 50.0 1.0 1.0 3.5E-01 0.12 0 0
2 2 2 50.0 1.0 1.0 3.5E-01 0.12 0 0

Summary

Summary for eph_Tinfile keyword
Required/optional Type Accepted values Default See also Remarks
Optional String Short file names 'NULL' nonadiabatic_processes If this file is not provided the FDM mesh is constructed from given input data.
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