exercises:2014_uzh_molsim:h2o_md
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exercise:mm_uzh:h2o_md [2014/05/05 18:01] – talirz | exercise:mm_uzh:h2o_md [2014/05/06 12:50] – talirz | ||
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* Check that the MD is energy conserving and // | * Check that the MD is energy conserving and // | ||
- | * FIXME additional question | ||
</ | </ | ||
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* Plot $g_{O-O}(r)$ at 200, 300 and 400 K into the same graph. | * Plot $g_{O-O}(r)$ at 200, 300 and 400 K into the same graph. | ||
* What are the differences in the height of the first peak? | * What are the differences in the height of the first peak? | ||
- | * What does this say about the structure of the liquid and is this expected? | + | * What does this say about the structure of the liquid and is this expected? |
* Compare to experimental data '' | * Compare to experimental data '' | ||
</ | </ |
exercises/2014_uzh_molsim/h2o_md.txt · Last modified: 2020/08/21 10:15 by 127.0.0.1