Table 4 The comparison for the calculated statistical parameters of GC, AC and literature models for density, refractive index, heat capacity, speed of sound and surface tension.

From: Group contribution and atomic contribution models for the prediction of various physical properties of deep eutectic solvents

Property

Model

Number of investigated data

AARD%

Maximum ARD%

AAD

S

Density

AC

1239

2.49

42.79

0.03 g/cm3

0.05 g/cm3

GC

1239

1.44

19.29

0.02 g/cm3

0.03 g/cm3

Haghbakhsh et al.25

1239

3.12

18.00

0.03 g/cm3

0.05 g/cm3

Rackett120

1239

17.01

109.32

0.22 g/cm3

0.30 g/cm3

Spencer and Danner121

1239

27.72

281.68

0.32 g/cm3

0.46 g/cm3

Mjalli et al.18

1239

27.37

279.43

0.31 g/cm3

0.45 g/cm3

Refractive index

AC

1117

1.03

4.46

0.01

0.02

GC

1117

0.37

3.61

0.01

0.01

Taherzadeh et al.20

1117

1.05

4.86

0.02

0.02

Riazi and Daubert122

1117

11.09

47.32

0.13

0.21

Riazi and Daubert123

1117

10.53

45.67

0.12

0.20

Riazi and Al-Sahhaf124

1117

1.81

6.32

0.04

0.04

Lorentz–Lorenz125

1117

1.98

7.01

0.05

0.05

Heat capacity

AC

461

9.93

47.48

34.42 J/mol K

58.63 J/mol K

GC

461

3.26

47.60

8.87 J/mol K

21.31 J/mol K

Taherzadeh et al.23

461

4.89

45.87

13.03 J/mol K

18.93 J/mol K

Ahmadi et al.126

461

16.66

38.06

105.71 J/mol K

135.10 J/mol K

Huang et al.127

461

55.24

74.12

170.11 J/mol K

188.07 J/mol K

Ge et al.128

461

19.00

122.32

111.80 J/mol K

139.47 J/mol K

Oster et al.129

461

16.51

116.59

106.00 J/mol K

131.74 J/mol K

Speed of sound

AC

398

4.52

78.50

117.19 m/s

144.99 m/s

GC

398

1.62

20.05

28.64 m/s

59.37 m/s

Peyrovedin et al.24

398

5.59

34.18

99.55 m/s

144.82 m/s

Haghbakhsh et al.130

398

10.17

75.39

208.43 m/s

340.46 m/s

Hekayati and Esmaeilzadeh131

398

9.19

36.43

175.98 m/s

224.38 m/s

Gardas and Coutinho132

398

9.27

31.98

183.66 m/s

238.12 m/s

Singh and Singh133

398

40.04

96.91

708.20 m/s

863.87 m/s

Surface tension

AC

538

7.80

88.97

3.84 mN/m

6.29 mN/m

GC

538

7.59

62.35

3.75 mN/m

6.07 mN/m

Haghbakhsh et al.22

538

8.61

59.67

4.51 mN/m

6.95 mN/m

Escobedo and Mansoori134

538

79.92

90.37

38.17 mN/m

39.71 mN/m

Curl and Pitzer135

538

16.51

162.40

9.52 mN/m

12.80 mN/m

Gharagheizi et al.136

538

22.45

57.17

11.50 mN/m

14.16 mN/m