autoplex.benchmark.phonons.utils

Utility functions for benchmarking jobs.

Functions

compare_plot	Save DFT and ML phonon band-structure overlay plot for visual comparison.
compute_bandstructure_benchmark_metrics	Compute phonon band-structure benchmark metrics and generate associated plots.
get_rmse	Compute root mean squared error (rmse) between DFT and ML phonon band-structure.
rmse_qdep_plot	Save q dependent root mean squared error plot between DFT and ML phonon band-structure.

Classes

TYPE_CHECKING

bool(x) -> bool