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Author Topic: Questions on MD simulaton  (Read 2935 times)

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Offline frank

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Questions on MD simulaton
« on: March 30, 2015, 11:51 »
I am  performing  a MD simulation in ATK. But I have two questions:
1.I choose NVT Berendsen for NVT simulations,but I don't find the algorithm for Newton's Law which offers?
2.where can I set boundary conditions?
Thank you!
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Offline kstokbro

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Re: Questions on MD simulaton
« Reply #1 on: April 1, 2015, 10:36 »
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