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QuantumATK W-2024.09 version released on Sep 9, 2024
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Green-Kubo Equilibrium Molecular Dynamics
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Topic: Green-Kubo Equilibrium Molecular Dynamics (Read 3593 times)
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aknair
Regular QuantumATK user
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Green-Kubo Equilibrium Molecular Dynamics
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on:
June 28, 2024, 17:15 »
Is there a way to calculate thermal conductivity in ATK using the Green-Kubo Equilibrium Molecular Dynamics Technique?
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Anders Blom
QuantumATK Staff
Supreme QuantumATK Wizard
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Re: Green-Kubo Equilibrium Molecular Dynamics
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July 30, 2024, 00:12 »
Planned new feature in future version!
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Green-Kubo Equilibrium Molecular Dynamics