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arn-all / Kinetic_Monte_Carlo_Code

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Move all physical parameters to the config file #2

Closed arn-all closed 4 years ago

arn-all commented 4 years ago

Get rid of hard-coded values

arn-all commented 4 years ago

the unpinning rate depends on , which seems not to appear clearly in KinkPairNucleation. Yet, it should be in the config file too

arn-all commented 4 years ago

seems to be hard-coded to 1.8 eV (but Zhao, Marian (2018) gives −0.25eV) : 

devent1.rate = 1.5 * 10e12 * exp(-(1.8 - extraenergy) / kT);
arn-all commented 4 years ago

1.8 eV is from their Nature 2020 article

arn-all commented 4 years ago

Done with : 09b101c8a9a940ebbbe062f8590d04e69221463d (ebkp) 2b5888f577e2514371337ea63d2b1701cd3f52c5 (migration energy) 9d9273f4d63d63c7b70e610cf86fdc15d0fe336a (solutes position)