. 2023 Feb 9;19(4):1300–1309. doi: 10.1021/acs.jctc.2c01191

Table 8. PBE Eigenvalues (eV) of the Lowest Conduction States of FCC MgO Referred to the Valence Band Maximum, Compared to LAPW, PAW, and Pseudopotential (SG15) Results.

	AEPW (this work)	FLAPW³⁶	FLAPW³⁸	PAW³⁹	SG15
Γ	4.83	4.84	4.77	4.75	4.80
X	9.14	9.15	9.14	9.15	9.19
L	7.94	8.01	7.93	7.91	7.95