Copper¶

Copper supercells (40 × 40 × 40 Å) across the amorphous → nanocrystalline axis, refined with MACE-MP0.

Final MACE structures¶

Energy across regimes¶

Copper energy per atom across regimes

Summary¶

regime	atoms	orient accepts	final E (eV/atom)
Liquid	5202	0	-3.825
Amorphous	5202	0	-3.974
SRO	5202	1	-3.980
MRO	5202	2	-3.997
LRO	5202	4	-4.015
Nanocrystalline	5202	5	-4.035

Per-regime pages¶