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dftlibs / xcfun

XCFun: A library of exchange-correlation functionals with arbitrary-order derivatives
https://dftlibs.org/xcfun/
Mozilla Public License 2.0
58 stars 32 forks source link

Outdated documentation #32

Closed fabijan5 closed 4 years ago

fabijan5 commented 6 years ago

I have noticed that the definition on how to call certain functions from the "http://dftlibs.org/xcfun/" webpage is outdated. For example, when specifying the functions such as: xc_set_mode(fun, XC_VARS_AB);

error is reported: error: use of undeclared identifier 'XC_VARS_AB' xc_set_mode(fun, XC_VARS_AB);

bast commented 6 years ago

Thanks for reporting and sorry for the confusion! It is indeed on my desk to clean it up. I will self-assign once I really start working on this, though.

robertodr commented 4 years ago

Working on this in #106 Documentation will appear on xcfun.readthedocs.io