Investigation of equilibria in solution. Determination of equilibrium constants with the HYPERQUAD suite of programs

被引:3068
作者
Gans, P
Sabatini, A
Vacca, A
机构
[1] UNIV FLORENCE,DIPARTIMENTO CHIM,I-50144 FLORENCE,ITALY
[2] CNR,IST STUDIO STEREOCHIM & ENERGET COMPOSTI COOR,I-50132 FLORENCE,ITALY
关键词
equilibrium constant; potentiometry; solutions; spectrophotometry;
D O I
10.1016/0039-9140(96)01958-3
中图分类号
O65 [分析化学];
学科分类号
070302 ; 081704 ;
摘要
A new suite of 10 programs concerned with equilibrium constants and solution equilibria is described. The suite includes data preparation programs, pretreatment programs, equilibrium constant refinement and post-run analysis. Data preparation is facilitated by a customized data editor. The pretreatment programs include manual trial and error data fitting, speciation diagrams, end-point determination, absorbance error determination, spectral baseline corrections, factor analysis and determination of molar absorbance spectra. Equilibrium constants can be determined from potentiometric data and/or spectrophotometric data. A new data structure is also described in which information on the model and on experimental measurements are kept in separate files.
引用
收藏
页码:1739 / 1753
页数:15
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