Quantum chemical computation-based strategy for alternating least squares initialization in multivariate curve resolution analysis of spectral-pH data

Romina Brasca; Anne-Marie Kelterer; Marcel Maeder; Mirta R.  Alcaráz; Maria J. Culzoni

doi:10.1016/j.microc.2018.04.022

Quantum chemical computation-based strategy for alternating least squares initialization in multivariate curve resolution analysis of spectral-pH data

Romina Brasca, Anne-Marie Kelterer, Marcel Maeder, Mirta R. Alcaráz, Maria J. Culzoni

Institute of Physical and Theoretical Chemistry (6350)

Research output: Contribution to journal › Article › peer-review

Original language	English
Pages (from-to)	183-188
Journal	Microchemical Journal
Volume	140
DOIs	https://doi.org/10.1016/j.microc.2018.04.022
Publication status	Published - 18 Apr 2018

Fields of Expertise

Advanced Materials Science

Access to Document

10.1016/j.microc.2018.04.022

Cite this

@article{18a16da0421648d49e2e1accb499244b,

title = "Quantum chemical computation-based strategy for alternating least squares initialization in multivariate curve resolution analysis of spectral-pH data",

author = "Romina Brasca and Anne-Marie Kelterer and Marcel Maeder and Alcar{\'a}z, {Mirta R.} and Culzoni, {Maria J.}",

year = "2018",

month = apr,

day = "18",

doi = "10.1016/j.microc.2018.04.022",

language = "English",

volume = "140",

pages = "183--188",

journal = "Microchemical Journal",

issn = "1095-9149",

publisher = "Elsevier B.V.",

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TY - JOUR

T1 - Quantum chemical computation-based strategy for alternating least squares initialization in multivariate curve resolution analysis of spectral-pH data

AU - Brasca, Romina

AU - Kelterer, Anne-Marie

AU - Maeder, Marcel

AU - Alcaráz, Mirta R.

AU - Culzoni, Maria J.

PY - 2018/4/18

Y1 - 2018/4/18

U2 - 10.1016/j.microc.2018.04.022

DO - 10.1016/j.microc.2018.04.022

M3 - Article

SN - 1095-9149

VL - 140

SP - 183

EP - 188

JO - Microchemical Journal

JF - Microchemical Journal

ER -