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Quantitative laser-induced breakdown spectroscopy data using peak area step-wise regression analysis: an alternative method for interpretation of Mars science laboratory results

Description/Abstract

The ChemCam instrument on the Mars Science Laboratory (MSL) will include a laser-induced breakdown spectrometer (LIBS) to quantify major and minor elemental compositions. The traditional analytical chemistry approach to calibration curves for these data regresses a single diagnostic peak area against concentration for each element. This approach contrasts with a new multivariate method in which elemental concentrations are predicted by step-wise multiple regression analysis based on areas of a specific set of diagnostic peaks for each element. The method is tested on LIBS data from igneous and metamorphosed rocks. Between 4 and 13 partial regression coefficients are needed to describe each elemental abundance accurately (i.e., with a regression line of R{sup 2} > 0.9995 for the relationship between predicted and measured elemental concentration) for all major and minor elements studied. Validation plots suggest that the method is limited at present by the small data set, and will work best for prediction of concentration when a wide variety of compositions and rock types has been analyzed.

Creator/Author: Clegg, Samuel M [Los Alamos National Laboratory] ; Barefield, James E [Los Alamos National Laboratory] ; Wiens, Roger C [Los Alamos National Laboratory] ; Dyar, Melinda D [MT HOLYOKE COLLEGE] ; Schafer, Martha W [LSU] ; Tucker, Jonathan M [MT HOLYOKE COLLEGE]
Publication Date:2008 Jan 01
OSTI Identifier:OSTI ID: 956617
Report Number(s):LA-UR-08-07585; LA-UR-08-7585
DOE Contract Number:AC52-06NA25396
Other Number(s):Journal ID: ISSN 0094-8276; GPRLAJ; TRN: US201016%%2302
Resource Type:Journal Article
Resource Relation:Journal Name: Geophysical Research Letters
Research Org:Los Alamos National Laboratory (LANL)
Sponsoring Org:DOE
Subject:37; 58; BREAKDOWN; CALIBRATION; CHEMISTRY; DATA ANALYSIS; DIAGRAMS; ELEMENTS; IGNEOUS ROCKS; MARS PLANET; METAMORPHIC ROCKS; REGRESSION ANALYSIS; ROCKS; SPECTROMETERS; SPECTROSCOPY; VALIDATION
Country of Publication:United States
Language:English
Update Date:2010 Sep 22

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