Author Topic: How to compare the qmtp potential with my mtp potential  (Read 3234 times)

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Offline xylx9497

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Dear Sir/Madam,
          I've trained my MTP of IGZO. Also I've found the 2022-U version contained IGZO MTP. But the IGZO MTP contained is MTP_IGZO_small.qmtp. Could you help me with the comparision between my MTP and the contained MTP. The *.qmtp seems to be unrecognized. Thanks a lot for your help.

Offline Anders Blom

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Re: How to compare the qmtp potential with my mtp potential
« Reply #1 on: March 17, 2023, 20:28 »
What specifically do you mean by "unrecognized"? If you share the exact input and output of your QuantumATK script it will be a lot easier to figure out how to solve this.

If you want to run a small test with the built-in potential, the attached scripts works in U-2022.12 provided you have an updated license file. I set it up very easily using the GUI.