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Adding non-collinear functionals

Status: Open.

#169 In dftlibs/xcfun;

· sunqm opened on Jul 6, 2023

B3LYP is wrong

Status: Open.

#167 In dftlibs/xcfun;

· susilehtola opened on Oct 21, 2022

can I get the derivative on the density matrix?

Status: Open.

#165 In dftlibs/xcfun;

· wesley-stone opened on Jun 20, 2022

Irreproducible results

Status: Open.

#163 In dftlibs/xcfun;

· susilehtola opened on May 3, 2022

metaGGA functionals not usable through the Python bindings

Status: Open.

#141 In dftlibs/xcfun;

· robertodr opened on Sep 15, 2020

[openSUSE] W: shared-lib-calls-exit from RPMLINT

api

low-prioLow priorityLow priority

planning

restructuring

Status: Open.

#139 In dftlibs/xcfun;

· kevinsmia1939 opened on Sep 2, 2020

Rework C++ and Python interfaces

Status: Open.

#112 In dftlibs/xcfun;

· robertodr opened on Jan 29, 2020

Semi Contracted Mode

Status: Open.

#92 In dftlibs/xcfun;

· ilfreddy opened on Feb 8, 2019

set_param(XC_RANGESEP_MU)

help wanted

question

Status: Open.

#73 In dftlibs/xcfun;

· sunqm opened on May 3, 2018