Addded a file for parsing CML
Replaced isnear with np.isclose. Added additional doctests to
nuclear repulsion terms and gamma function.
Julia version of basic PyQuante routines.
Got basic Julia HF code working. Negligible changes to two/hamiltonians.
Added a trivial readme.
Commented out the example code for the scipy.special version of the
incomplete gamma function code, since I don't want to require
these routines for a pyquante2 build.
Updated readme
Updated julia version of pyquante
Beginning to add shells to basis sets
Minor changes made while testing
Beginnings of shell support in HGP module
Good old-fashioned SCF module. Useful for debugging and printing
Removed printing from earlier tests
Minor changes to make test suite work
Initial tests of shell_basisset pass
Removed printing used during debugging
Moved shell information into normal basis sets
Reformatted to make doctests work
Changed print statements to make py3 tests work
Continued to work on shell code