q3::PlanewaveProvenanceRecord Class Reference

#include <init.hpp>

Inheritance diagram for q3::PlanewaveProvenanceRecord:

Public Member Functions
	QuantumSystemProvenanceRecord (const InputData &input)
Public Member Functions inherited from q3::QuantumSystemProvenanceRecord
	QuantumSystemProvenanceRecord (const InputData &input)
virtual	~QuantumSystemProvenanceRecord ()=default
nlohmann::json	to_json () const
	The provenance block, grouped the way the consumer's record is.

Protected Member Functions
void	add_representation_method_details (nlohmann::json &method) const override
Protected Member Functions inherited from q3::QuantumSystemProvenanceRecord
const InputData &	input () const
	The input the calculation consumed, for a subclass to report on in turn.

Detailed Description

Definition at line 27 of file init.hpp.

Member Function Documentation

add_representation_method_details()

void q3::PlanewaveProvenanceRecord::add_representation_method_details ( nlohmann::json &  ) const

inlineoverrideprotectedvirtual

Hook: add what the concrete representation contributes to "method".

The base record describes a quantum system that has been solved; it cannot say what a basis set or a dataset was, because at this level there is none. A subclass that knows one adds it here.

Reimplemented from q3::QuantumSystemProvenanceRecord.

Reimplemented in q3::PseudopotentialProvenanceRecord.

Definition at line 32 of file init.hpp.

References q3::InputData::charge_density_energy_cutoff, q3::QuantumSystemProvenanceRecord::input(), and q3::InputData::wavefunction_energy_cutoff.

Referenced by q3::PseudopotentialProvenanceRecord::add_representation_method_details().

QuantumSystemProvenanceRecord()

q3::QuantumSystemProvenanceRecord::QuantumSystemProvenanceRecord ( const InputData &  input )

inlineexplicit

Definition at line 71 of file init.hpp.

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The documentation for this class was generated from the following file:

• src/io/provenance/planewave/init.hpp