An ERROR occurred, When using USPEX 10.5 for high-pressure phase prediction,.
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Sweat Dream
Mar 26, 2024, 4:19:51 AMMar 26
to USPEX
Dear USPEX Developers,
I hope this email finds you well.
I am writing to seek assistance regarding an issue I encountered while using USPEX.
I hope this email finds you well.
I am writing to seek assistance regarding an issue I encountered while using USPEX.
The error INPUT.txt and INCAR are as shown below：
===== USPEX ERROR @ 15:11:26 26-Mar-2024 =====
Many structures failed after relaxation,
Plz check the input files. Results maybe unreliable.
Possible reasons: high bestFrac, bad optimization parameters or contraints.
Many structures failed after relaxation,
Plz check the input files. Results maybe unreliable.
Possible reasons: high bestFrac, bad optimization parameters or contraints.
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