4  Hill 模型拟合

4.1 加载数据

加载数据完成

4.2 模型定义

Hill 吸附等温线模型:

\[Q_e = \frac{a \cdot C_e^b}{c^b + C_e^b}\]

其中: - \(Q_e\):平衡吸附量 (mg/g) - \(C_e\):平衡浓度 (mg/L) - \(a\):最大吸附量 (Qmax) - \(b\):Hill 系数(协同性指标) - \(c\):半饱和浓度

4.3 批量拟合

成功拟合的 Hill 模型数量: 12 

4.4 提取参数

Hill 模型拟合参数
term estimate std.error statistic p.value model AIC
a 8.0038762 0.7200401 11.115875 0.0000000 MSP550.Cd 76.52788
b 1.4287481 0.3642669 3.922256 0.0007823 MSP550.Cd 76.52788
c 2.5665532 0.5982800 4.289886 0.0003249 MSP550.Cd 76.52788
a 19.2470357 1.3350737 14.416460 0.0000000 OSR550.Cd 119.09724
b 3.0353059 0.8659666 3.505108 0.0021068 OSR550.Cd 119.09724
c 0.7139736 0.0616499 11.581092 0.0000000 OSR550.Cd 119.09724
a 20.5042393 0.5390578 38.037184 0.0000000 OSR700.Cd 79.58973
b 6.4295712 0.6163833 10.431125 0.0000000 OSR700.Cd 79.58973
c 0.3350948 0.0056165 59.662223 0.0000000 OSR700.Cd 79.58973
a 18.3108051 1.1382199 16.087230 0.0000000 WSP550.Cd 111.44485
b 6.2979755 1.8118992 3.475897 0.0022570 WSP550.Cd 111.44485
c 1.5353873 0.0593481 25.870893 0.0000000 WSP550.Cd 111.44485
a 41.1812272 8.0386367 5.122912 0.0000449 MSP550.Pb 157.14994
b 0.6617788 0.2010828 3.291075 0.0034816 MSP550.Pb 157.14994
c 1.3904100 1.2357966 1.125112 0.2732370 MSP550.Pb 157.14994
a 46.3375991 4.0909387 11.326887 0.0000000 OSR550.Pb 167.40250
b 2.7074090 0.6668066 4.060261 0.0005626 OSR550.Pb 167.40250
c 0.2195488 0.0286679 7.658353 0.0000002 OSR550.Pb 167.40250
a 55.5964829 1.4609837 38.054144 0.0000000 OSR700.Pb 150.23208
b 3.1925942 0.3172106 10.064589 0.0000000 OSR700.Pb 150.23208
c 0.1371422 0.0053845 25.469577 0.0000000 OSR700.Pb 150.23208
a 42.4195992 2.7891334 15.208882 0.0000000 WSP550.Pb 174.70681
b 2.0984723 0.5419719 3.871921 0.0007278 WSP550.Pb 174.70681
c 0.1882348 0.0283675 6.635580 0.0000007 WSP550.Pb 174.70681
a 3.2975458 0.3072202 10.733492 0.0000000 MSP550.Zn 56.46378
b 0.9247301 0.4849506 1.906854 0.0703138 MSP550.Zn 56.46378
c 0.1077068 0.0604857 1.780700 0.0894344 MSP550.Zn 56.46378
a 8.5814960 0.2958041 29.010738 0.0000000 OSR550.Zn 58.29593
b 1.6328404 0.2274833 7.177846 0.0000004 OSR550.Zn 58.29593
c 0.0684596 0.0088296 7.753425 0.0000001 OSR550.Zn 58.29593
a 10.7458416 0.4229413 25.407408 0.0000000 OSR700.Zn 74.83078
b 4.0051805 0.5739579 6.978179 0.0000007 OSR700.Zn 74.83078
c 0.0454366 0.0024306 18.693380 0.0000000 OSR700.Zn 74.83078
a 6.1890590 0.6251819 9.899612 0.0000000 WSP550.Zn 94.71990
b 3.7048709 1.2920266 2.867488 0.0092181 WSP550.Zn 94.71990
c 0.0344481 0.0044329 7.771001 0.0000001 WSP550.Zn 94.71990

4.5 模型比较(AIC)

Langmuir vs Hill 模型 AIC 比较
Biochar.Metal AIC_Langmuir AIC_Hill Delta_AIC Better
MSP550.Cd MSP550.Cd 76.99019 76.52788 -0.4623153 Hill
OSR550.Cd OSR550.Cd 131.95024 119.09724 -12.8530029 Hill
OSR700.Cd OSR700.Cd 145.80662 79.58973 -66.2168895 Hill
WSP550.Cd WSP550.Cd 125.14517 111.44485 -13.7003226 Hill
MSP550.Pb MSP550.Pb 157.76040 157.14994 -0.6104548 Hill
OSR550.Pb OSR550.Pb 175.85644 167.40250 -8.4539465 Hill
OSR700.Pb OSR700.Pb 195.78422 150.23208 -45.5521407 Hill
WSP550.Pb WSP550.Pb 183.26278 174.70681 -8.5559694 Hill
MSP550.Zn MSP550.Zn 54.48690 56.46378 1.9768824 Langmuir
OSR550.Zn OSR550.Zn 67.43911 58.29593 -9.1431740 Hill
OSR700.Zn OSR700.Zn 100.98682 74.83078 -26.1560454 Hill
WSP550.Zn WSP550.Zn 101.68844 94.71990 -6.9685356 Hill

4.6 拟合曲线

Figure 4.1: Hill 模型拟合曲线(全范围)
Figure 4.2: Hill 模型拟合曲线(低浓度区域放大)

4.7 残差诊断

Figure 4.3: Hill 模型残差图

4.8 保存结果

Hill 模型结果已保存