neb_simulation
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neb_simulation [2009/12/04 11:53] prokop |
neb_simulation [2009/12/04 11:53] prokop |
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| **Note**: The files ''answer_image.bas'' can be directly used for a restart of NEB-optimization process. | **Note**: The files ''answer_image.bas'' can be directly used for a restart of NEB-optimization process. | ||
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| ==== Main sources of convergence troubles: ==== | ==== Main sources of convergence troubles: ==== | ||
neb_simulation.txt ยท Last modified: 2011/02/18 13:13 (external edit)
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