CIESC Journal ›› 2021, Vol. 72 ›› Issue (10): 5028-5039.DOI: 10.11949/0438-1157.20210607
• Thermodynamics • Previous Articles Next Articles
Daqun CAO1(),Yan JIN2,Hang CHEN1,Jianguo YU1()
Received:
2021-04-29
Revised:
2021-06-11
Online:
2021-10-05
Published:
2021-10-05
Contact:
Jianguo YU
通讯作者:
于建国
作者简介:
曹大群(1995—),男,硕士研究生,基金资助:
CLC Number:
Daqun CAO,Yan JIN,Hang CHEN,Jianguo YU. Phase equilibria determination and solubility calculation of the quaternary system CaCl2-SrCl2-BaCl2-H2O at 338.15 K[J]. CIESC Journal, 2021, 72(10): 5028-5039.
曹大群,金艳,陈杭,于建国. 338.15 K时四元体系CaCl2-SrCl2-BaCl2-H2O相平衡测定及溶解度计算[J]. 化工学报, 2021, 72(10): 5028-5039.
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No. | 液相组成/% | 密度/(g/cm3) | 湿渣组成/% | 平衡固相 | ||||
---|---|---|---|---|---|---|---|---|
CaCl2 | SrCl2 | H2O | CaCl2 | SrCl2 | H2O | |||
1,A | 57.83 | 0.00 | 42.17 | 1.6465 | — | — | — | C |
2 | 56.43 | 0.54 | 43.03 | 1.6215 | 58.19 | 0.75 | 41.06 | C |
3,E | 55.16 | 0.98 | 43.83 | 1.6192 | 56.44 | 2.85 | 40.71 | C+S |
4 | 53.61 | 1.07 | 45.32 | 1.5908 | 43.68 | 15.98 | 40.34 | S |
5 | 50.54 | 1.25 | 48.21 | 1.5750 | 25.76 | 40.35 | 33.89 | S |
6 | 48.12 | 1.32 | 50.56 | 1.5675 | 26.61 | 36.98 | 36.41 | S |
7 | 47.32 | 1.66 | 51.02 | 1.5418 | 22.02 | 44.61 | 33.37 | S |
8 | 42.61 | 3.63 | 53.76 | 1.5027 | 21.67 | 41.90 | 36.43 | S |
9 | 40.6 | 4.87 | 54.53 | 1.4785 | 19.80 | 43.78 | 36.42 | S |
10 | 33.15 | 10.51 | 56.34 | 1.4644 | 16.56 | 46.83 | 36.61 | S |
11 | 26.79 | 15.91 | 57.3 | 1.4559 | 10.47 | 55.76 | 33.77 | S |
12 | 19.85 | 22.42 | 57.73 | 1.4345 | 5.21 | 65.35 | 29.44 | S |
13 | 11.03 | 30.99 | 57.98 | 1.4493 | 5.78 | 55.26 | 38.95 | S |
14 | 9.05 | 33.38 | 57.57 | 1.4506 | 3.12 | 63.96 | 32.92 | S |
15,C | 8.57 | 34.07 | 57.36 | 1.4564 | 1.89 | 58.87 | 39.24 | S+SH |
16 | 1.11 | 43.77 | 55.12 | 1.4963 | 0.71 | 51.31 | 47.98 | S+SH |
17,B | 0.00 | 45.30 | 54.70 | 1.5226 | — | — | — | S |
Table 1 Solubility data of the ternary system CaCl2-SrCl2-H2O at 338.15 K
No. | 液相组成/% | 密度/(g/cm3) | 湿渣组成/% | 平衡固相 | ||||
---|---|---|---|---|---|---|---|---|
CaCl2 | SrCl2 | H2O | CaCl2 | SrCl2 | H2O | |||
1,A | 57.83 | 0.00 | 42.17 | 1.6465 | — | — | — | C |
2 | 56.43 | 0.54 | 43.03 | 1.6215 | 58.19 | 0.75 | 41.06 | C |
3,E | 55.16 | 0.98 | 43.83 | 1.6192 | 56.44 | 2.85 | 40.71 | C+S |
4 | 53.61 | 1.07 | 45.32 | 1.5908 | 43.68 | 15.98 | 40.34 | S |
5 | 50.54 | 1.25 | 48.21 | 1.5750 | 25.76 | 40.35 | 33.89 | S |
6 | 48.12 | 1.32 | 50.56 | 1.5675 | 26.61 | 36.98 | 36.41 | S |
7 | 47.32 | 1.66 | 51.02 | 1.5418 | 22.02 | 44.61 | 33.37 | S |
8 | 42.61 | 3.63 | 53.76 | 1.5027 | 21.67 | 41.90 | 36.43 | S |
9 | 40.6 | 4.87 | 54.53 | 1.4785 | 19.80 | 43.78 | 36.42 | S |
10 | 33.15 | 10.51 | 56.34 | 1.4644 | 16.56 | 46.83 | 36.61 | S |
11 | 26.79 | 15.91 | 57.3 | 1.4559 | 10.47 | 55.76 | 33.77 | S |
12 | 19.85 | 22.42 | 57.73 | 1.4345 | 5.21 | 65.35 | 29.44 | S |
13 | 11.03 | 30.99 | 57.98 | 1.4493 | 5.78 | 55.26 | 38.95 | S |
14 | 9.05 | 33.38 | 57.57 | 1.4506 | 3.12 | 63.96 | 32.92 | S |
15,C | 8.57 | 34.07 | 57.36 | 1.4564 | 1.89 | 58.87 | 39.24 | S+SH |
16 | 1.11 | 43.77 | 55.12 | 1.4963 | 0.71 | 51.31 | 47.98 | S+SH |
17,B | 0.00 | 45.30 | 54.70 | 1.5226 | — | — | — | S |
No. | 液相组成/% | 密度/(g/cm3) | 湿渣组成/% | 平衡固相 | ||||
---|---|---|---|---|---|---|---|---|
CaCl2 | BaCl2 | H2O | CaCl2 | BaCl2 | H2O | |||
1 | 57.83 | 0.00 | 42.17 | 1.6465 | — | — | — | C |
2,E | 54.95 | 0.16 | 44.89 | 1.6122 | 45.46 | 21.85 | 32.69 | C+B |
3 | 48.12 | 0.46 | 51.42 | 1.5403 | 31.19 | 30.47 | 38.34 | B |
4 | 31.15 | 3.37 | 65.48 | 1.3872 | 19.51 | 33.89 | 46.6 | B |
5 | 18.96 | 9.37 | 71.67 | 1.2995 | 8.72 | 50.16 | 41.12 | B |
6 | 7.84 | 21.09 | 71.07 | 1.3051 | 3.79 | 53.65 | 42.56 | B |
7 | 0.00 | 32.19 | 67.81 | 1.3095 | — | — | — | B |
Table 2 Solubility data of the ternary system CaCl2-BaCl2-H2O at 338.15 K
No. | 液相组成/% | 密度/(g/cm3) | 湿渣组成/% | 平衡固相 | ||||
---|---|---|---|---|---|---|---|---|
CaCl2 | BaCl2 | H2O | CaCl2 | BaCl2 | H2O | |||
1 | 57.83 | 0.00 | 42.17 | 1.6465 | — | — | — | C |
2,E | 54.95 | 0.16 | 44.89 | 1.6122 | 45.46 | 21.85 | 32.69 | C+B |
3 | 48.12 | 0.46 | 51.42 | 1.5403 | 31.19 | 30.47 | 38.34 | B |
4 | 31.15 | 3.37 | 65.48 | 1.3872 | 19.51 | 33.89 | 46.6 | B |
5 | 18.96 | 9.37 | 71.67 | 1.2995 | 8.72 | 50.16 | 41.12 | B |
6 | 7.84 | 21.09 | 71.07 | 1.3051 | 3.79 | 53.65 | 42.56 | B |
7 | 0.00 | 32.19 | 67.81 | 1.3095 | — | — | — | B |
No. | 液相组成/% | 密度/(g/cm3) | 湿渣组成/% | 平衡固相 | ||||
---|---|---|---|---|---|---|---|---|
SrCl2 | BaCl2 | H2O | SrCl2 | BaCl2 | H2O | |||
1 | 45.30 | 0.00 | 54.7 | 1.5226 | — | — | — | S |
2 | 40.98 | 0.45 | 58.57 | 1.4953 | 53.17 | 0.58 | 46.25 | S |
3 | 39.11 | 0.79 | 60.10 | 1.4804 | 59.39 | 2.14 | 38.47 | S |
4,E | 37.86 | 1.29 | 60.85 | 1.4721 | 38.94 | 18.68 | 42.38 | B+S |
5 | 31.20 | 3.01 | 65.79 | 1.4182 | 10.31 | 57.94 | 31.75 | B |
6 | 19.06 | 11.77 | 69.17 | 1.3518 | 9.64 | 48.51 | 41.85 | B |
7 | 8.91 | 21.89 | 69.20 | 1.3259 | 2.48 | 67.39 | 30.13 | B |
8 | 0.00 | 32.19 | 67.81 | 1.3095 | — | — | — | B |
Table 3 Solubility data of the ternary system SrCl2-BaCl2-H2O at 338.15 K
No. | 液相组成/% | 密度/(g/cm3) | 湿渣组成/% | 平衡固相 | ||||
---|---|---|---|---|---|---|---|---|
SrCl2 | BaCl2 | H2O | SrCl2 | BaCl2 | H2O | |||
1 | 45.30 | 0.00 | 54.7 | 1.5226 | — | — | — | S |
2 | 40.98 | 0.45 | 58.57 | 1.4953 | 53.17 | 0.58 | 46.25 | S |
3 | 39.11 | 0.79 | 60.10 | 1.4804 | 59.39 | 2.14 | 38.47 | S |
4,E | 37.86 | 1.29 | 60.85 | 1.4721 | 38.94 | 18.68 | 42.38 | B+S |
5 | 31.20 | 3.01 | 65.79 | 1.4182 | 10.31 | 57.94 | 31.75 | B |
6 | 19.06 | 11.77 | 69.17 | 1.3518 | 9.64 | 48.51 | 41.85 | B |
7 | 8.91 | 21.89 | 69.20 | 1.3259 | 2.48 | 67.39 | 30.13 | B |
8 | 0.00 | 32.19 | 67.81 | 1.3095 | — | — | — | B |
No. | 液相组成/% | 干盐J?necke指数 J(CaCl2)+J(SrCl2)+J(BaCl2)=100 | 平衡固相 | 密度/ (g/cm3) | ||||||
---|---|---|---|---|---|---|---|---|---|---|
CaCl2 | SrCl2 | BaCl2 | H2O | CaCl2 | SrCl2 | BaCl2 | H2O | |||
1,E1 | 54.95 | 0 | 0.17 | 44.88 | 99.69 | 0.00 | 0.31 | 81.42 | C+B | 1.6122 |
2,E2 | 55.16 | 0.98 | 0 | 43.86 | 98.25 | 1.75 | 0.00 | 78.13 | C+S | 1.6192 |
3,E3 | 52.38 | 0.75 | 0.16 | 46.71 | 98.29 | 1.41 | 0.30 | 87.65 | C+S | 1.5933 |
4 | 43.61 | 1.83 | 0.15 | 54.41 | 95.66 | 4.01 | 0.33 | 119.35 | B+S | 1.5226 |
5 | 35.07 | 6.42 | 0.18 | 58.33 | 84.16 | 15.41 | 0.43 | 139.98 | B+S | 1.4893 |
6 | 24.68 | 13.91 | 0.26 | 61.15 | 63.53 | 35.80 | 0.67 | 157.40 | B+S | 1.4618 |
7 | 19.08 | 18.93 | 0.36 | 61.63 | 49.73 | 49.34 | 0.94 | 160.62 | B+S | 1.4705 |
8 | 14.82 | 22.97 | 0.48 | 61.73 | 38.72 | 60.02 | 1.25 | 161.30 | B+S | 1.4717 |
9 | 8.14 | 29.43 | 0.77 | 61.66 | 21.23 | 76.76 | 2.01 | 160.82 | B+S | 1.4739 |
10,E4 | 0 | 37.86 | 1.29 | 60.85 | 0.00 | 96.70 | 3.30 | 155.43 | B+S | 1.4721 |
Table 4 Solubility data of the quaternary system CaCl2-SrCl2-BaCl2-H2O at 338.15 K
No. | 液相组成/% | 干盐J?necke指数 J(CaCl2)+J(SrCl2)+J(BaCl2)=100 | 平衡固相 | 密度/ (g/cm3) | ||||||
---|---|---|---|---|---|---|---|---|---|---|
CaCl2 | SrCl2 | BaCl2 | H2O | CaCl2 | SrCl2 | BaCl2 | H2O | |||
1,E1 | 54.95 | 0 | 0.17 | 44.88 | 99.69 | 0.00 | 0.31 | 81.42 | C+B | 1.6122 |
2,E2 | 55.16 | 0.98 | 0 | 43.86 | 98.25 | 1.75 | 0.00 | 78.13 | C+S | 1.6192 |
3,E3 | 52.38 | 0.75 | 0.16 | 46.71 | 98.29 | 1.41 | 0.30 | 87.65 | C+S | 1.5933 |
4 | 43.61 | 1.83 | 0.15 | 54.41 | 95.66 | 4.01 | 0.33 | 119.35 | B+S | 1.5226 |
5 | 35.07 | 6.42 | 0.18 | 58.33 | 84.16 | 15.41 | 0.43 | 139.98 | B+S | 1.4893 |
6 | 24.68 | 13.91 | 0.26 | 61.15 | 63.53 | 35.80 | 0.67 | 157.40 | B+S | 1.4618 |
7 | 19.08 | 18.93 | 0.36 | 61.63 | 49.73 | 49.34 | 0.94 | 160.62 | B+S | 1.4705 |
8 | 14.82 | 22.97 | 0.48 | 61.73 | 38.72 | 60.02 | 1.25 | 161.30 | B+S | 1.4717 |
9 | 8.14 | 29.43 | 0.77 | 61.66 | 21.23 | 76.76 | 2.01 | 160.82 | B+S | 1.4739 |
10,E4 | 0 | 37.86 | 1.29 | 60.85 | 0.00 | 96.70 | 3.30 | 155.43 | B+S | 1.4721 |
离子 | σ/? | ε/(kJ/mol) | Z | 文献 |
---|---|---|---|---|
Cl- | 4.830 | 0.053 | -1 | [ |
Ca2+ | 3.170 | 1.886 | 2 | [ |
Sr2+ | 3.553 | 0.4948 | 2 | [ |
Ba2+ | 3.750 | 0.1696 | 2 | [ |
Table 5 L-J parameters adopted in the present work
离子 | σ/? | ε/(kJ/mol) | Z | 文献 |
---|---|---|---|---|
Cl- | 4.830 | 0.053 | -1 | [ |
Ca2+ | 3.170 | 1.886 | 2 | [ |
Sr2+ | 3.553 | 0.4948 | 2 | [ |
Ba2+ | 3.750 | 0.1696 | 2 | [ |
盐 | 溶解度/%(质量) | 数密度/(个/nm3) |
---|---|---|
CaCl2 | 57.83 | 7.44 |
SrCl2 | 45.30 | 3.15 |
BaCl2 | 32.19 | 1.37 |
Table 6 Solubility data of the involved pure salts in water at 338.15 K
盐 | 溶解度/%(质量) | 数密度/(个/nm3) |
---|---|---|
CaCl2 | 57.83 | 7.44 |
SrCl2 | 45.30 | 3.15 |
BaCl2 | 32.19 | 1.37 |
三元体系 | 实验共饱和点组成 | 计算共饱和点组成 |
---|---|---|
CaCl2-SrCl2-H2O | w(CaCl2)=55.16% w(SrCl2)=0.98% | w(CaCl2)=57.48% w(SrCl2)=0.38% |
CaCl2-BaCl2-H2O | w(CaCl2)=54.95% w(BaCl2)=0.16% | w(CaCl2)=54.74% w(BaCl2)=0.01% |
SrCl2-BaCl2-H2O | w(SrCl2)=1.29% w(BaCl2)=37.86% | w(SrCl2)=1.41% w(BaCl2)=39.82% |
Table 7 Experimental composition and calculation results of co-saturation point of ternary system
三元体系 | 实验共饱和点组成 | 计算共饱和点组成 |
---|---|---|
CaCl2-SrCl2-H2O | w(CaCl2)=55.16% w(SrCl2)=0.98% | w(CaCl2)=57.48% w(SrCl2)=0.38% |
CaCl2-BaCl2-H2O | w(CaCl2)=54.95% w(BaCl2)=0.16% | w(CaCl2)=54.74% w(BaCl2)=0.01% |
SrCl2-BaCl2-H2O | w(SrCl2)=1.29% w(BaCl2)=37.86% | w(SrCl2)=1.41% w(BaCl2)=39.82% |
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