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#5 Carbon structures

Version 1.0
pending
Burkhard Schmidt
CNTs (1)
2013-06-10
2012-11-08
Burkhard Schmidt
No

Use carbon nano-tube builder (possibly also graphene, fullerene builder) to generate initial conformations

Discussion

  • Burkhard Schmidt

    Burkhard Schmidt - 2012-11-08
    • status: open --> pending
     

  • Burkhard Schmidt

    Burkhard Schmidt - 2012-11-26
    • milestone: 1.0 --> 2.0
     

  • Burkhard Schmidt

    Burkhard Schmidt - 2012-11-26
    • summary: Carbon nano-tubes --> Carbon structures
    • Description has changed:

    Diff:

    --- old
+++ new
@@ -1 +1 @@
-Use carbon nano-tube builder (possibly also graphene builder) to generate initial conformations 
+Use carbon nano-tube builder (possibly also graphene, fullerene builder) to generate initial conformations
     

  • Burkhard Schmidt

    Burkhard Schmidt - 2012-11-26

    Perhaps implement also intra-carbon force fields that would be able to generate those structures ?!?

     

  • Burkhard Schmidt

    Burkhard Schmidt - 2013-05-31
    • Milestone: Version 2.0 --> Version 1.0
     

  • Burkhard Schmidt

    Burkhard Schmidt - 2013-06-10

    Also water in CNT!!!

     

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