benzen_structure_optimization
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benzen_structure_optimization [2009/11/24 15:13] jelen |
benzen_structure_optimization [2011/02/18 13:13] 127.0.0.1 external edit |
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| - | Here we describe how to perform structure optimization of a simple molecule using new version of Fireball. | + | Here we describe how to perform structure optimization of a simple molecule using the new version of the Fireball code. |
| - | These are minimal steps required to optimize atomic structure using quenching optimization method: | + | There are minimal steps required to optimize atomic structure using quenching optimization method: |
benzen_structure_optimization.txt · Last modified: 2018/03/08 15:44 (external edit)
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