IMAGE N: Difference between revisions

Revision as of 09:54, 19 June 2026

Description: The IMAGE_1 allows defining the INCAR settings for calculations using images.

IMAGE_1 can define the INCAR settings used for a calculation in an image calculation, e.g., 01 for nudged elastic band calculations, parallel tempering, and thermodynamic integration. Simply change the _1 in IMAGE_1 to _2, _3, etc for the other images (e.g., 02, 03, etc):

IMAGE_1 {
#Image 1 INCAR tags
}

IMAGE_2 {
#Image 2 INCAR tags
}
...

@@ Line 1: / Line 1: @@
-{{TAGDEF|IMAGE_N}}
+{{TAGDEF|IMAGE_1}}
-Description: The {{TAG|IMAGE_N}} allows defining the {{FILE|INCAR}} settings for calculations using [[IMAGES | images]].
+Description: The {{TAG|IMAGE_1}} allows defining the {{FILE|INCAR}} settings for calculations using [[IMAGES | images]].
 ----
-{{TAG|IMAGE_N}} can define the {{FILE|INCAR}} settings used for a calculation in an image calculation, e.g., <code>01</code>, <code>02</code> for [[Nudged elastic bands|nudged elastic band]] calculations, [[LTEMPER|parallel tempering]], and [[VCAIMAGES|thermodynamic integration]].
+{{TAG|IMAGE_1}} can define the {{FILE|INCAR}} settings used for a calculation in an image calculation, e.g., <code>01</code> for [[Nudged elastic bands|nudged elastic band]] calculations, [[LTEMPER|parallel tempering]], and [[VCAIMAGES|thermodynamic integration]]. Simply change the <code>_1</code> in {{TAG|IMAGE_1}} to <code>_2</code>, <code>_3</code>, etc for the other images (e.g., <code>02</code>, <code>03</code>, etc):
+ {{TAGBL|IMAGE_1}} {
+ #Image 1 INCAR tags
+ }
+ {{TAGBL|IMAGE_2}} {
+ #Image 2 INCAR tags
+ }
+ ...
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