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exercises:2016_uzh_cmest:geometry_optimization

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exercises:2016_uzh_cmest:geometry_optimization [2016/10/12 11:16] – [3. Step: Optimizing the geometry with alternative geometry] tmuellerexercises:2016_uzh_cmest:geometry_optimization [2016/10/19 12:04] – [2. Step: Optimizing the geometry] tmueller
Line 113: Line 113:
 &GLOBAL &GLOBAL
   PROJECT ethane1_opt   PROJECT ethane1_opt
-  RUN_TYPE GEOM_OPT+  RUN_TYPE GEO_OPT
   PRINT_LEVEL MEDIUM   PRINT_LEVEL MEDIUM
 &END GLOBAL &END GLOBAL
exercises/2016_uzh_cmest/geometry_optimization.txt · Last modified: 2020/08/21 10:15 by 127.0.0.1