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qc2nl
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qc2
Facilitate the orchestration of quantum chemistry applications on quantum computers
https://qc2.readthedocs.io/
Apache License 2.0
3
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Added HIMS workshop notebook
#66
Cmurilochem
closed
2 months ago
0
Add default qchem filename and download notebook links to docs
#65
Cmurilochem
closed
1 week ago
0
Add links to download notebooks from the documentation
#64
Cmurilochem
closed
1 week ago
0
Add default filename to qc2Data class
#63
Cmurilochem
closed
1 week ago
0
Add pypi package
#62
Cmurilochem
opened
4 months ago
0
Minor fixes to allow for full installation without pennylane
#61
Cmurilochem
closed
1 week ago
1
Fix installation in case of Qiskit-Nature only
#60
Cmurilochem
closed
1 week ago
0
Extend VQE to include orbital optimization
#59
Cmurilochem
closed
2 months ago
1
Make qc2 compatible with Quantum Inspire
#58
Cmurilochem
opened
6 months ago
0
Add Multiple Ansatz choice to PennyLane VQE wrapper
#57
Cmurilochem
opened
6 months ago
0
Check qc2-ase DIRAC compatibility with DIRAC24
#56
Cmurilochem
opened
6 months ago
0
Create VQE and algorithms wrappers
#55
Cmurilochem
closed
2 months ago
0
Dev online docs
#54
Cmurilochem
closed
6 months ago
2
Extend VQE to include orbital optimization
#53
Cmurilochem
closed
5 months ago
0
Image for qc2 logo in the repo
#52
Cmurilochem
opened
9 months ago
1
Explore possible lectures/workshops/congresses to disseminate qc2
#51
Cmurilochem
opened
9 months ago
0
Integral calculator on the fly + database of QC2 schemas
#50
Cmurilochem
opened
9 months ago
0
Add `qc2Data` Pennylane plugin
#49
Cmurilochem
opened
10 months ago
1
Update `build.yml` and CI/CD workflow
#48
Cmurilochem
closed
8 months ago
0
Format docstrings and add sphinx docs
#47
Cmurilochem
closed
7 months ago
0
Add sphinx documentation
#46
Cmurilochem
closed
7 months ago
0
Dev ADF calculator
#45
Cmurilochem
opened
10 months ago
0
Fix in ROSE tests
#44
Cmurilochem
closed
10 months ago
0
CI/CD fixes
#43
Cmurilochem
closed
8 months ago
0
Fix CI/CD
#42
Cmurilochem
closed
10 months ago
0
Dev psi4 calculator
#41
Cmurilochem
closed
10 months ago
0
Fix in build.yml
#40
Cmurilochem
closed
10 months ago
0
Correct cicd and imports
#39
Cmurilochem
closed
10 months ago
0
Correct CI/CD and package imports
#38
Cmurilochem
closed
10 months ago
0
Derivative integrals
#37
Emieeel
opened
10 months ago
1
Optional dependencies
#36
Emieeel
closed
9 months ago
1
Refactor ROSE calculator
#35
Cmurilochem
closed
10 months ago
0
refactor `qc2Data` class and qc2 architecture
#34
Cmurilochem
opened
11 months ago
0
Refactor `qc2Data` class
#33
Cmurilochem
closed
11 months ago
0
Refactor `qc2Data` class
#32
Cmurilochem
closed
11 months ago
0
Refactor ASE base class and ASE calculators
#31
Cmurilochem
closed
10 months ago
0
Refactor ASE calculators and `BaseQc2ASECalculator` class
#30
Cmurilochem
closed
10 months ago
0
remove file
#29
NicoRenaud
closed
1 year ago
0
Remove mymodule
#28
NicoRenaud
closed
1 year ago
0
Refactoring qc2Data class
#27
Cmurilochem
closed
1 year ago
0
Extend VQE to include orbital optimization
#26
Cmurilochem
closed
7 months ago
2
Test qc2 with real qc hardware and interesting use cases
#25
Cmurilochem
opened
1 year ago
0
Extend VQE to include orbital optimization
#24
Cmurilochem
closed
2 months ago
0
Refactor ROSE-ASE calculator
#23
Cmurilochem
closed
10 months ago
0
Add Qiskit and Pennylane extensions
#22
Cmurilochem
closed
1 year ago
0
Add Qiskit and Pennylane plugins
#21
Cmurilochem
closed
1 year ago
0
Implemented QCSchema as a new qc2 data format with test cases using DIRAC & PySCF
#20
Cmurilochem
closed
1 year ago
0
Test implementation of QCSchema as standard qc2 format
#19
Cmurilochem
closed
1 year ago
0
Added python scripts of the QC2schema proposed by Luuk in .dev folder
#18
Cmurilochem
closed
9 months ago
0
Explore Data structure from Qiskit and/or Pennylane
#17
NicoRenaud
closed
1 year ago
1
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