RgpotEngineGprGate Struct Reference

#include <engine_c_abi.h>

Public Attributes
unsigned	magic
	RGPOT_ENGINE_GPR_GATE_MAGIC.
unsigned	version
	RGPOT_ENGINE_GPR_GATE_VERSION.
double	sigmaLoFactor
	Answer from the model below this multiple of its likelihood noise.
double	sigmaHiFactor
	Above this multiple the geometry is not learned from.
double	certifyBelowForce
	Predicted force magnitude under this (eV/Angstrom) forces a ground-truth call, so a driver's convergence claim is checked rather than trusted.
unsigned long long	refitTrainingRevisions
	Refit cadence in training-set appends; zero refits at every incorporation boundary.

Detailed Description

Definition at line 104 of file engine_c_abi.h.

Member Data Documentation

certifyBelowForce

double RgpotEngineGprGate::certifyBelowForce

Predicted force magnitude under this (eV/Angstrom) forces a ground-truth call, so a driver's convergence claim is checked rather than trusted.

Non-positive disables the certificate.

Definition at line 114 of file engine_c_abi.h.

magic

unsigned RgpotEngineGprGate::magic

RGPOT_ENGINE_GPR_GATE_MAGIC.

Definition at line 105 of file engine_c_abi.h.

refitTrainingRevisions

unsigned long long RgpotEngineGprGate::refitTrainingRevisions

Refit cadence in training-set appends; zero refits at every incorporation boundary.

Definition at line 117 of file engine_c_abi.h.

sigmaHiFactor

double RgpotEngineGprGate::sigmaHiFactor

Above this multiple the geometry is not learned from.

Definition at line 110 of file engine_c_abi.h.

sigmaLoFactor

double RgpotEngineGprGate::sigmaLoFactor

Answer from the model below this multiple of its likelihood noise.

Definition at line 108 of file engine_c_abi.h.

version

unsigned RgpotEngineGprGate::version

RGPOT_ENGINE_GPR_GATE_VERSION.

Definition at line 106 of file engine_c_abi.h.

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

• /home/runner/work/eOn/eOn/include/eon/potentials/Rgpot/engine_c_abi.h