Elements | PW | PBE | PBEsol | TPSS | SCAN | HF | PBE0 |
K | −598.1992 | −599.7111 | −598.9171 | −599.9402 | −599.9368 | −599.1648 | −599.7514 |
Ca | −675.7353 | −677.3495 | −676.5013 | −677.5859 | −677.5821 | −676.7582 | −677.3925 |
Sc | −758.6778 | −760.3916 | −759.4911 | −760.6306 | −760.6267 | −759.7357 | −760.4263 |
Ti | −847.2954 | −849.1098 | −848.1569 | −849.3527 | −849.3488 | −848.3701 | −849.1210 |
V | −941.7335 | −943.6496 | −942.6440 | −943.8973 | −943.8932 | −942.8037 | −943.6192 |
Cr | −1042.2086 | −1044.2318 | −1043.1756 | −1044.4882 | −1044.4841 | −1043.1418 | −1044.0567 |