Qibochem 0.0.1

What's Changed

• Psi4 driver by @damarkian in #2
• PySCF as driver by @damarkian in #3
• Create molecule.py by @damarkian in #4
• Create test_molecule.py by @damarkian in #5
• Finish first version of molecular integral driver by @chmwzc in #6
• Add functionality to read geometry from .xyz file by @chmwzc in #7
• Update molecule.py by @damarkian in #8
• Add HF circuit ansatz with JW/BK mapping by @chmwzc in #9
• Clean up Molecule class by @chmwzc in #10
• Add RHF embedding into Molecule class by @chmwzc in #11
• Add UCC ansatz by @chmwzc in #12
• Fix bug in expectation.py by @chmwzc in #13
• Minor fix to HF embedding by @chmwzc in #15
• Minor fix to UCC code for using set_parameters() by @chmwzc in #16
• Simplify Hamiltonian functions in Molecule class by @chmwzc in #19
• refactoring code with pre-commit by @scarrazza in #21
• adding precommit instructions by @scarrazza in #20
• [pre-commit.ci] pre-commit autoupdate by @pre-commit-ci in #28
• Add some convenience functions for running UCC by @chmwzc in #27
• Dev doc202306 by @damarkian in #30
• [pre-commit.ci] pre-commit autoupdate by @pre-commit-ci in #31
• Poetry and workflow changes by @TL231 in #29
• [pre-commit.ci] pre-commit autoupdate by @pre-commit-ci in #32
• [pre-commit.ci] pre-commit autoupdate by @pre-commit-ci in #33
• moved expectation function and mic changes by @TL231 in #34
• Bump tornado from 6.3.2 to 6.3.3 by @dependabot in #37
• Scipy dependancybot fix by @TL231 in #38
• Merging current progress of docs to main by @damarkian in #39
• Misc fixes for doc by @TL231 in #41
• [pre-commit.ci] pre-commit autoupdate by @pre-commit-ci in #44
• [pre-commit.ci] pre-commit autoupdate by @pre-commit-ci in #45
• [pre-commit.ci] pre-commit autoupdate by @pre-commit-ci in #46
• Customizable hardware-efficient ansatz by @damarkian in #43
• [pre-commit.ci] pre-commit autoupdate by @pre-commit-ci in #47
• API documentation by @chmwzc in #40
• Basis rotation circuit by @chmwzc in #35
• [pre-commit.ci] pre-commit autoupdate by @pre-commit-ci in #48
• Dependency update by @TL231 in #50
• [pre-commit.ci] pre-commit autoupdate by @pre-commit-ci in #51
• Fix expectation with measurements code by @chmwzc in #52
• [pre-commit.ci] pre-commit autoupdate by @pre-commit-ci in #55
• Set default charge/spin if not given in .xyz file by @chmwzc in #56
• [pre-commit.ci] pre-commit autoupdate by @pre-commit-ci in #57
• Docs completed by @damarkian in #58
• Update init.py to fit pyproject.toml by @damarkian in #61
• Update init.py to follow Qibo by @chmwzc in #62
• [pre-commit.ci] pre-commit autoupdate by @pre-commit-ci in #66
• Fix release issues by @damarkian in #65
• [pre-commit.ci] pre-commit autoupdate by @pre-commit-ci in #68
• Documentation: Edit and move some pages from Getting started to Tutorials by @chmwzc in #67

New Contributors

• @damarkian made their first contribution in #2
• @chmwzc made their first contribution in #6
• @scarrazza made their first contribution in #21
• @pre-commit-ci made their first contribution in #28
• @TL231 made their first contribution in #29
• @dependabot made their first contribution in #37

Full Changelog: https://github.com/qiboteam/qibochem/commits/v0.0.1