QuantumATK Forum
QuantumATK => General Questions and Answers => Topic started by: Roc2019 on June 17, 2020, 06:27
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Dear Sir,
Bease on the ATK calculations (2019.12.sp1), could one get the superconducting transition temperature from the Allen – Dynes formula, like the Quantum Espresso does.
Thank you.
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Hi,
QuantumATK does not currently have a finalized feature for the superconducting transition temperature.
It could be done in script as all the ingredients are present, e.g. the electron-phonon coupling matrix elements needed for the Eliashberg function.
It will most likely be a feature in the future but when will depend on the number of requests.
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Thank you Dr. Gunst .
It is great if you can share a script of calculating the Tc of superconducting before a new version released with this feature.