Eph Tinfile - Revision history

Uttiyo: /* Note (additional uses) */

2024-05-31T18:28:22Z

Note (additional uses)

2024-04-12T09:19:52Z

Summary

2024-03-11T13:39:01Z

Summary

2024-03-11T13:28:56Z

Summary

2023-10-02T10:52:18Z

Note (additional uses)

2023-10-02T10:50:54Z

2023-09-28T11:23:20Z

2023-09-28T11:22:58Z

2023-09-27T13:04:42Z

2023-09-27T13:03:55Z

@@ Line 35: / Line 35: @@
 ===Note (additional uses)===
-(1) To simulate with an external source term in S_e, at least one value under the 'flag' column must be set equal to 1.
+(1) To simulate with an external source term in S_e, at least one value (corresponding to the particular location in the mesh) under the 'flag' column must be set equal to 1.
 (2) To simulate (non-linear case) using temperature-dependent parameters C_e and K_e, at least one value under 'T_dyn_flag' column must be set equal to 1. Then <math>C_e(T_e)</math> and <math>K_e(T_e)</math> has to be provided through a file named as "Te-dependent_e-parameters.txt", which has a simple format as shown below:

@@ Line 70: / Line 70: @@
 | 'NULL'
 | <code>[[nonadiabatic_processes]]</code>
-| If this file is not provided the FDM mesh is constructed from given input (or default) data. Put the name of file within quotes.
+| If this file is not provided the FDM mesh is constructed from given input (or default) data. Put the name of file within quotes. In case of restarted runs, the appropriate temperature map of the electronic system should be provided from the last run.
 |}

@@ Line 70: / Line 70: @@
 | 'NULL'
 | <code>[[nonadiabatic_processes]]</code>
-| If this file is not provided the FDM mesh is constructed from given input (or default) data. Put name of file within quotes.
+| If this file is not provided the FDM mesh is constructed from given input (or default) data. Put the name of file within quotes.
 |}

@@ Line 70: / Line 70: @@
 | 'NULL'
 | <code>[[nonadiabatic_processes]]</code>
-| If this file is not provided the FDM mesh is constructed from given input data.
+| If this file is not provided the FDM mesh is constructed from given input (or default) data. Put name of file within quotes.
 |}

@@ Line 37: / Line 37: @@
 (1) To simulate with an external source term in S_e, at least one value under the 'flag' column must be set equal to 1.
-(2) To simulate using temperature-dependent parameters C_e and K_e, at least one value under 'T_dyn_flag' column must be set equal to 1. Then <math>C_e(T_e)</math> and <math>K_e(T_e)</math> has to be provided through a file named as "Te-dependent_e-parameters.txt", which has a simple format as shown below:
+(2) To simulate (non-linear case) using temperature-dependent parameters C_e and K_e, at least one value under 'T_dyn_flag' column must be set equal to 1. Then <math>C_e(T_e)</math> and <math>K_e(T_e)</math> has to be provided through a file named as "Te-dependent_e-parameters.txt", which has a simple format as shown below:
   # First 3 comment lines
   # Te-dependent_e-parameters.txt file

@@ Line 16: / Line 16: @@
   [Note that mesh indices i, j, k must start from 1 not 0.]
-===Example===
+===Example (mostly used)===
+  #
   # 3 lines of comments
@@ Line 33: / Line 33: @@
 2 2 50.0 1.0 1.0 3.5E-01 0.12 0 0
 2 2 50.0 1.0 1.0 3.5E-01 0.12 0 0
 === Summary ===

@@ Line 14: / Line 14: @@
   ….
   Values are provided for the full mesh.
-  [Note that mesh indices must start from 1 not 0.]
+  [Note that mesh indices i, j, k must start from 1 not 0.]
 ===Example===

@@ Line 1: / Line 1: @@
-<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 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.
+<code>eph_Tinfile</code> takes the name of the file containing 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.
 st line – any comments
@@ Line 14: / Line 14: @@
   ….
   Values are provided for the full mesh.
 ===Example===

@@ Line 20: / Line 20: @@
+  #
 2 2 1
-.0 30.0
+  -30.0 30.0
-.0 30.0
+  -30.0 30.0
-.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 50.0 1.0 1.0 3.5E-07 0.12 0 0
+1 1 50.0 1.0 1.0 3.5E-01 0.12 0 0
-1 1 50.0 1.0 1.0 3.5E-07 0.12 0 0
+1 1 50.0 1.0 1.0 3.5E-01 0.12 0 0
-2 1 50.0 1.0 1.0 3.5E-07 0.12 0 0
+2 1 50.0 1.0 1.0 3.5E-01 0.12 0 0
-2 1 50.0 1.0 1.0 3.5E-07 0.12 0 0
+2 1 50.0 1.0 1.0 3.5E-01 0.12 0 0
-1 2 50.0 1.0 1.0 3.5E-07 0.12 0 0
+1 2 50.0 1.0 1.0 3.5E-01 0.12 0 0
-1 2 50.0 1.0 1.0 3.5E-07 0.12 0 0
+1 2 50.0 1.0 1.0 3.5E-01 0.12 0 0
-2 2 50.0 1.0 1.0 3.5E-07 0.12 0 0
+2 2 50.0 1.0 1.0 3.5E-01 0.12 0 0
-2 2 50.0 1.0 1.0 3.5E-07 0.12 0 0
+2 2 50.0 1.0 1.0 3.5E-01 0.12 0 0
 === Summary ===
 {| class="wikitable"
-|+ Summary for <code>eph_betafile</code> keyword
+|+ Summary for <code>eph_Tinfile</code> keyword
 ! style="text-align:left;"| Required/optional
 ! style="text-align:left;"| Type
@@ Line 44: / Line 44: @@
 ! style="text-align:left;"| Remarks
 |-
-| Required
+| Optional
 | String
 | Short file names
 | 'NULL'
-| <code>[[electronic_stopping]]</code>, <code>[[estop_filename]]</code>, <code>[[nonadiabatic_processes]]</code>
+| <code>[[nonadiabatic_processes]]</code>
-| A coupling parameter file must be provided.
+| If this file is not provided the FDM mesh is constructed from given input data.
 |}