Raman spectra;
FTIR microscopy spectra;
near-infrared spectra;
mass spectra;
Simplisma;
D O I:
10.1016/S0169-7439(96)00061-5
中图分类号:
TP [自动化技术、计算机技术];
学科分类号:
0812 ;
摘要:
This paper describes a contribution to Elsevier's data base of files. The spectral files are: (a) Raman spectra of a reaction followed in time, (b) FTIR microscopy spectra of a polymer laminate, (c) MR spectra of mixtures of five solvents, (d) time resolved mass spectra of a three-component mixture. The application of self-modeling mixture analysis will be demonstrated using the Simplisma and Tsimplisma approach, Matlab functions to reproduce these results are included in the paper.