.. _xc_evaluator_module: Mapped XC Evaluators ==================== Function evaluators operate on transformed descriptors and return both a value and its derivatives with respect to the descriptors. Mapped DFT kernels apply the stored feature transforms and energy baselines. The top-level mapped XC object combines all kernel components with their shared feature settings. Original mapped interface ------------------------- .. automodule:: ciderpress.dft.xc_evaluator :members: XCEvalSerializable, FuncEvaluator, KernelEvaluator, RBFEvaluator, AntisymRBFEvaluator, SpinRBFEvaluator, SplineSetEvaluator, NNEvaluator, GlobalLinearEvaluator, MappedDFTKernel, ModelWithNormalizer, MappedXC :undoc-members: Libxc-baseline/full-XC interface -------------------------------- .. automodule:: ciderpress.dft.xc_evaluator2 :members: MappedDFTKernel2, MappedXC2