[BUG] UHF reference for MSD

JoonhoLee-Group / ipie

ipie stands for Intelligent Python-based Imaginary-time Evolution with a focus on simplicity and speed.

Apache License 2.0

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Open AdrianLopez1 opened 1 year ago

AdrianLopez1 commented 1 year ago

Describe the bug Code should fail when using MSD trial with UHF reference.

fdmalone commented 1 year ago

@AdrianLopez1 if you can, please add this check and a unit test to catch it. Thanks!