Issues
- 2
About analytic formula for the integrals
#40 opened by fate1997 - 2
spherical gaussian type orbitals
#38 opened by moritzgubler - 2
get_norm()
#34 opened by Exlonk - 1
HF calculation using custom basis sets
#31 opened by ifilot - 0
Removal of `build_integrals`
#30 opened by ifilot - 1
Final iteration after RHF convergence
#27 opened by Emieeel - 0
Error handling in plotter function
#29 opened by ifilot - 0
Fix 32 bit builds via cibuildwheel
#28 opened by ifilot - 0
Molecule class should safeguard for vector input
#17 opened by ifilot - 1
Derivatives of electron repulsion integrals
#9 opened by alexm-gc - 2
pip install pyqint Not Working
#5 opened by emilyrobertskang - 1
conda install -c ifilot pyqint Not Working
#6 opened by paramnaik