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Richie9384
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I'm reading a paper on a simulation of graphene and carbon nanotube growth on SiC, in the paper they give a few computational details about the structural optimization of the SiC model using a conjugate gradient method and they state the maximal force component as
[tex]1x10^{-4}Ha/a_o[/tex]
What is this unit? I'm assuming Ha per angstrom...but Ha seem to be a unit of area...I need to convert to eV/Angstrom
[tex]1x10^{-4}Ha/a_o[/tex]
What is this unit? I'm assuming Ha per angstrom...but Ha seem to be a unit of area...I need to convert to eV/Angstrom