Table 2 Comparison of models’ prediction accuracy on unseen alloy systems.

From: A general and transferable deep learning framework for predicting phase formation in materials

Alloy system

SNN3

SNN4

CNN1

CNN2

CNN3

Leave-one system-out test on 160 ternary systems

–

76.5%

–

77.3%

83.8%

Leave-one system-out test on Al–Ni–Zr system

62.3%

63.5%

68.4%

66.4%

80.3%

Ir–Ni–Ta–(B), Mg–Cu–Yb, S-bearing BMGs

17/28

9/28

18/28

23/28

27/28

RE6Fe72B22

5/13

8/13

7/13

8/13

10/13

Binary alloys outliers

8/18

16/18

13/18

13/18

16/18