kim-api  2.2.0-git+v2.1.3-git-55-g4abf2db1.GNU
An Application Programming Interface (API) for the Knowledgebase of Interatomic Models (KIM).
Todo List
Member KIM::COMPUTE_ARGUMENT_NAME::coordinates
Add more detailed description of argument.
Member KIM::COMPUTE_ARGUMENT_NAME::numberOfParticles
Add more detailed description of argument.
Member KIM::COMPUTE_ARGUMENT_NAME::partialEnergy
Add more detailed description of argument.
Member KIM::COMPUTE_ARGUMENT_NAME::partialForces
Add more detailed description of argument.
Member KIM::COMPUTE_ARGUMENT_NAME::partialParticleEnergy
Add more detailed description of argument.
Member KIM::COMPUTE_ARGUMENT_NAME::partialParticleVirial
Add more detailed description of argument.
Member KIM::COMPUTE_ARGUMENT_NAME::partialVirial
Add more detailed description of argument.
Member KIM::COMPUTE_ARGUMENT_NAME::particleContributing
Add more detailed description of argument.
Member KIM::COMPUTE_ARGUMENT_NAME::particleSpeciesCodes
Add more detailed description of argument.
Member KIM::COMPUTE_CALLBACK_NAME::GetNeighborList
Add more detailed description of callback.
Member KIM::COMPUTE_CALLBACK_NAME::ProcessD2EDr2Term
Add more detailed description of callback.
Member KIM::COMPUTE_CALLBACK_NAME::ProcessDEDrTerm
Add more detailed description of callback.
Member KIM::ComputeArguments::SetArgumentPointer (ComputeArgumentName const computeArgumentName, int const *const ptr)
Add more detailed description what it means to provide a NULL or non-NULL value for various SupportStatus'es.
Member KIM::ComputeArguments::SetCallbackPointer (ComputeCallbackName const computeCallbackName, LanguageName const languageName, Function *const fptr, void *const dataObject)
Add more detailed description what it means to provide a NULL or non-NULL value for various SupportStatus'es. Also, describe dataObject.
Member KIM::DATA_TYPE::Double
Add more detailed description of data type.
Member KIM::DATA_TYPE::Integer
Add more detailed description of data type.
Member KIM::LANGUAGE_NAME::c
Add more detailed description of the language.
Member KIM::LANGUAGE_NAME::cpp
Add more detailed description of the language.
Member KIM::LANGUAGE_NAME::fortran
Add more detailed description of the language.
Member KIM::Model::GetInfluenceDistance (double *const influenceDistance) const
Add more detailed description of influenceDistance. (or link to docs elsewhere?)
Member KIM::MODEL_ROUTINE_NAME::Compute
Add more detailed description of routine.
Member KIM::MODEL_ROUTINE_NAME::ComputeArgumentsCreate
Add more detailed description of routine.
Member KIM::MODEL_ROUTINE_NAME::ComputeArgumentsDestroy
Add more detailed description of routine.
Member KIM::MODEL_ROUTINE_NAME::Create
Add more detailed description of routine.
Member KIM::MODEL_ROUTINE_NAME::Destroy
Add more detailed description of routine.
Member KIM::MODEL_ROUTINE_NAME::Extension
Add more detailed description of routine.
Member KIM::MODEL_ROUTINE_NAME::Refresh
Add more detailed description of routine.
Member KIM::MODEL_ROUTINE_NAME::WriteParameterizedModel
Add more detailed description of routine.
Member KIM::ModelComputeArguments::ProcessD2EDr2Term (double const de, double const *const r, double const *const dx, int const *const i, int const *const j) const
Add more detailed description of Process mechanism.
Member KIM::ModelComputeArguments::ProcessDEDrTerm (double const de, double const r, double const *const dx, int const i, int const j) const
Add more detailed description of Process mechanism.
Member KIM::ModelCreate::SetInfluenceDistancePointer (double const *const influenceDistance)
Add more detailed description of influenceDistance (or link to docs elsewhere?)
Member KIM::ModelCreate::SetNeighborListPointers (int const numberOfNeighborLists, double const *const cutoffs, int const *const modelWillNotRequestNeighborsOfNoncontributingParticles)
Add more detailed description
Member KIM::ModelDriverCreate::SetInfluenceDistancePointer (double const *const influenceDistance)
Add more detailed description of influenceDistance (or link to docs elsewhere?)
Member KIM::ModelDriverCreate::SetNeighborListPointers (int const numberOfNeighborLists, double const *const cutoffs, int const *const modelWillNotRequestNeighborsOfNoncontributingParticles)
Add more detailed description
Member KIM::ModelRefresh::SetInfluenceDistancePointer (double const *const influenceDistance)
Add more detailed description of influenceDistance (or link to docs elsewhere?)
Member KIM::ModelRefresh::SetNeighborListPointers (int const numberOfNeighborLists, double const *const cutoffs, int const *const modelWillNotRequestNeighborsOfNoncontributingParticles)
Add more detailed description
Member KIM::SUPPORT_STATUS::notSupported
Add more detailed description of status.
Member KIM::SUPPORT_STATUS::optional
Add more detailed description of status.
Member KIM::SUPPORT_STATUS::required
Add more detailed description of status.
Member KIM::SUPPORT_STATUS::requiredByAPI
Add more detailed description of status.