User Tools

Site Tools


exercises:2017_ethz_mmm:stm

Differences

This shows you the differences between two versions of the page.

Link to this comparison view

Both sides previous revisionPrevious revision
Next revision
Previous revision
Last revisionBoth sides next revision
exercises:2017_ethz_mmm:stm [2017/05/25 12:23] dpasseroneexercises:2017_ethz_mmm:stm [2017/05/25 12:27] dpasserone
Line 124: Line 124:
 the first three C atoms will be labelled as C1 the first three C atoms will be labelled as C1
 and the C atoms from 4 to 6 will be labelled as C2 and the C atoms from 4 to 6 will be labelled as C2
 +<code>
 +222
 +   
 +  C1        6.0848407282        7.8280098155       21.6125989354
 +  C1        6.0865671686       12.7633436664       21.6071222309
 +  C1        6.1020007836       10.2957686990       21.6036624306
 +  C2       56.3447906713       10.2958157091       21.6033852713
 +  C2       56.3619529363        7.8280149623       21.6128774460
 +  C2       56.3601930737       12.7634261117       21.6063533886
 +  H         4.9837063610        7.8327959357       21.5912164696
 +  H         4.9855872642       12.7623732365       21.5844580428
 +</code>
  
 </note> </note>
- + 
 +<note important> 
 +Notice the difference between the images in TASK_2 and the images in TASK_1 
 +In TASK_2 we have KS states localised at the termini of the ribbon. 
 +These states are suppressed by the addiitonal H atoms in TASK_1 
 +</note>
  
exercises/2017_ethz_mmm/stm.txt · Last modified: 2020/08/21 10:15 by 127.0.0.1