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sync master/devel #347

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wants to merge 14 commits into from
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sync master/devel #347

wants to merge 14 commits into from

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kottmanj
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@kottmanj kottmanj commented Jun 6, 2024

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kottmanj and others added 14 commits February 29, 2024 11:08
* fixing syntax issue in post_init of dataclass (#327)

* fixing syntax issue in post_init of dataclass
* phoenics dropped due to maintenance resources
* more convenient randomization initialization for OO, avoiding numpy warnings

* Update version.py (#329)
* fixing syntax issue in post_init of dataclass (#327)
* phoenics support dropped
* more convenient randomization initialization for OO, avoiding numpy warnings
* Update qasm.py (#334)
Fixes issue #332
* added methods to create annihilation, creation, sz, sp, sm and s2 operators in qubit representation (#336)
* Update qasm.py (#335)
* Update ci_chemistry_psi4.yml (psi4 --> conda-forge channel)
* orbital names are better tracked through transformations (#338)
* keep basis info when re-initializing with mol.from_tequila
* orbital-optimization gives back molecule in the original basis
* more basis info (#339)
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Co-authored-by: davibinco <[email protected]>
@kottmanj kottmanj closed this Jun 6, 2024
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