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Lu et al. J Mater Inf 2022;2:11 I http://dx.doi.org/10.20517/jmi.2022.15 Page 15 of 18

0 ℎ =243650-50T
, ,
1 ℎ =160950-150T
, ,
2 ℎ =-60000
, ,

0
0 =24 + 32
0
: : − 238250 + 1397T − 185T ln(T)
0
0 =44 + 12 − 74620 + 2340T − 292T ln(T)
0
: :
1 : : : =-294600+450T
0 =24 + 20 − 12 ℎ − 329112
0
0
0

0 : : =302700
: : :
Ni Mo
3
0 3 = 4 + 11360 + 15T
0
:
0 3 = 3 + − 40160 + 23.2T
0
0
:

0
0
0 3 = 3 + + 68240
:

0 3 = 4 + 170600
0
:
Ni Mo
4
4 = −76820 + 734T − 128T ln(T) − 0.013T 2

△ − =2.4

△ − =-1.5

△ − =-1.2

0 =20700

∗:∗:∗: , :∗
0 =20700

∗:∗:∗: , :∗
0 =-1050000

∗:∗:∗: , , :∗

−
△ =1.3
−
△ =-2.42
△ − =0.85

0 =-30T
, :∗:∗:∗
0 =-100T
∗: , :∗:∗
0 =-100T
∗:∗: , :∗
bct
0 = 9 + 5 − 22110 − 7T
0
0
: :

0 = 9 ℎ + 5 − 7812 + 20T
0
0

: :

0
0 = 9 + 4 ℎ + + 69748
0
0
: :

0
0
0 = 13 ℎ + + 153020
: :

= −120000
, :∗:
DECLARATIONS
Authors’ contributions
Writing and editing: Lei XH, Lu XG
First-principles calculations: Liu W
Data analysis and discussion: Lei XH, Liu W, Luo F, Lu XG
Availability of data and materials
Supplementary materials are available from the Journal of Materials Informatics or from the authors.