Electronic stopping - Revision history

Uttiyo at 10:29, 29 March 2024

2024-03-29T10:29:55Z

2024-03-29T10:05:27Z

Summary

2024-03-29T10:03:20Z

2024-03-14T04:55:17Z

2023-11-06T13:33:21Z

2023-11-06T13:32:30Z

Example

2023-10-02T18:03:39Z

2023-10-02T11:22:50Z

2023-09-28T11:12:29Z

2023-09-28T11:11:53Z

@@ Line 3: / Line 3: @@
 The electronic stopping powers <math>S_e</math> are provided through an input data file, see related keyword <code>[[estop_filename]]</code>.
-This is typically invoked while simulating collision cascades of atoms. There are three input keywords for which typically inputs need to be provided if this calculation is invoked. These are as follows:
+This is typically invoked while simulating collision cascades of atoms. There are a few input keywords for which typically inputs need to be provided if this calculation is invoked. These are as follows:
 <code>eel_cut</code>, <code>eel_freq_out</code>, <code>estop_filename</code>, <code>eel_E_prev_time</code>, <code>eel_md_prev_time</code>, <code>eel_md_last_step</code>

@@ Line 22: / Line 22: @@
 | <code>.true.</code> or <code>.false.</code>
 | <code>.false.</code>
-| <code>[[eel_groupID]], </code><code>[[eel_cut]]</code>, <code>[[eel_freq_out]]</code>, <code>[[estop_filename]]</code>
+| <code>[[eel_groupID]]</code>, <code>[[eel_cut]]</code>, <code>[[eel_freq_out]]</code>, <code>[[estop_filename]]</code>, <code>[[eel_E_prev_time]]</code>, <code>[[eel_md_prev_time]]</code>, <code>[[eel_md_last_step]]</code>
 | Required functionality for simulating collision cascades
 |}

@@ Line 5: / Line 5: @@
 This is typically invoked while simulating collision cascades of atoms. There are three input keywords for which typically inputs need to be provided if this calculation is invoked. These are as follows:
-<code>eel_cut</code>, <code>eel_freq_out</code>, <code>estop_filename</code>
+<code>eel_cut</code>, <code>eel_freq_out</code>, <code>estop_filename</code>, <code>eel_E_prev_time</code>, <code>eel_md_prev_time</code>, <code>eel_md_last_step</code>
 === Summary ===

@@ Line 3: / Line 3: @@
 The electronic stopping powers <math>S_e</math> are provided through an input data file, see related keyword <code>[[estop_filename]]</code>.
-This is typically invoked while simulating collision cascades of atoms. There are three input keywords for which inputs need to be provided if this calculation is invoked. These are as follows:
+This is typically invoked while simulating collision cascades of atoms. There are three input keywords for which typically inputs need to be provided if this calculation is invoked. These are as follows:
 <code>eel_cut</code>, <code>eel_freq_out</code>, <code>estop_filename</code>

@@ Line 22: / Line 22: @@
 | <code>.true.</code> or <code>.false.</code>
 | <code>.false.</code>
-| <code>[[eel_cut]]</code>, <code>[[eel_freq_out]]</code>, <code>[[estop_filename]]</code>
+| <code>[[eel_groupID]], </code><code>[[eel_cut]]</code>, <code>[[eel_freq_out]]</code>, <code>[[estop_filename]]</code>
 | Required functionality for simulating collision cascades
 |}

@@ Line 29: / Line 29: @@
   electronic_stopping = .true.
   eel_cut = 1.0      ! in eV
   eel_freq_out = 10
   estop_filename = 'stopping-data-file'

← Older revision		Revision as of 18:03, 2 October 2023
Line 1:		Line 1:
−	<code>electronic_stopping</code> sets the option for doing a radiation cascade simulation where the electronic stopping will be taken into account ~~and~~ and electronic energy loss will be calculated. The force equation is modified by a friction-like term which is given as follows:	+	<code>electronic_stopping</code> sets the option for doing a radiation cascade simulation where the electronic stopping will be taken into account and electronic energy loss will be calculated. The force equation is modified by a friction-like term which is given as follows:
	<math>\mathbf{F}_I = -\mathbf{\nabla}_IU - S_e\frac{\mathbf{v}_I}{v_I}</math>.		<math>\mathbf{F}_I = -\mathbf{\nabla}_IU - S_e\frac{\mathbf{v}_I}{v_I}</math>.

← Older revision		Revision as of 11:22, 2 October 2023
Line 1:		Line 1:
−	<code>electronic_stopping</code> sets the option for doing a radiation cascade simulation where the electronic stopping will be taken into account and and electronic energy loss will be calculated. This is typically invoked while simulating collision cascades of atoms. There are three input keywords for which inputs need to be provided if this calculation is invoked. These are as follows:	+	<code>electronic_stopping</code> sets the option for doing a radiation cascade simulation where the electronic stopping will be taken into account and and electronic energy loss will be calculated. The force equation is modified by a friction-like term which is given as follows:
		+	<math>\mathbf{F}_I = -\mathbf{\nabla}_IU - S_e\frac{\mathbf{v}_I}{v_I}</math>.
		+
		+	The electronic stopping powers <math>S_e</math> are provided through an input data file, see related keyword <code>[[estop_filename]]</code>.
		+	This is typically invoked while simulating collision cascades of atoms. There are three input keywords for which inputs need to be provided if this calculation is invoked. These are as follows:

	<code>eel_cut</code>, <code>eel_freq_out</code>, <code>estop_filename</code>		<code>eel_cut</code>, <code>eel_freq_out</code>, <code>estop_filename</code>

@@ Line 1: / Line 1: @@
 <code>electronic_stopping</code> sets the option for doing a radiation cascade simulation where the electronic stopping will be taken into account and and electronic energy loss will be calculated. This is typically invoked while simulating collision cascades of atoms. There are three input keywords for which inputs need to be provided if this calculation is invoked. These are as follows:
-<code>eel_cut</code>, <code>eel_freq_out</code>, <code>estop_filename</code>.
+<code>eel_cut</code>, <code>eel_freq_out</code>, <code>estop_filename</code>
 === Summary ===

← Older revision		Revision as of 11:11, 28 September 2023
Line 1:		Line 1:
−	<code>electronic_stopping</code> sets the option for doing a radiation cascade simulation where the electronic stopping and electronic energy loss will be ~~taken into account~~. This is typically invoked while simulating collision cascades of atoms. There are three input keywords for which inputs need to be provided if this calculation is invoked. These are as follows:	+	<code>electronic_stopping</code> sets the option for doing a radiation cascade simulation where the electronic stopping will be taken into account and and electronic energy loss will be calculated. This is typically invoked while simulating collision cascades of atoms. There are three input keywords for which inputs need to be provided if this calculation is invoked. These are as follows:

	<code>eel_cut</code>, <code>eel_freq_out</code>, <code>estop_filename</code>.		<code>eel_cut</code>, <code>eel_freq_out</code>, <code>estop_filename</code>.