Integration of SuperCam based chemical imaging and clustering to correlate geochemistry and mineralogy in heterogeneous samples

L Laura García-Gómez I Iratxe Población T Tomás Delgado J Javier Laserna M Marizú Velásquez P Pavel Pořízka J Jakub Buday J Jozef Kaiser A Alvaro Lobato (Department of Chemistry and Chemical Engineering, Chalmers University of Technology) A Ana I. Casado M Mercedes Taravillo J Juan Manuel Madariaga J Julene Aramendia F Fernando Rull (Espectroscopía Raman e Infrarroja aplicado a Cosmogeoquímica y Astrobiología Research Group, Department of Applied Physics, Universidad de Valladolid) D Daniel Carrizo J Jesús Martínez-Frías I Iñaki Vadillo J José Miguel Vadillo F Francisco J. Fortes L Luisa M. Cabalín

Abstract

Abstract Peridotites are ultramafic rocks whose mineralogical diversity makes them suitable case studies for testing analytical methodologies. In this study, a peridotite sample from the Ronda massif (Málaga, Spain) was examined demonstrating a practical methodology for distinguishing geochemically distinct regions within complex lithologies. The sample was analyzed using a multi-instrumental approach combining laser-induced breakdown spectroscopy (LIBS), micro-energy dispersive X-ray fluorescence (µ-EDXRF), and Raman spectroscopy, all of them integrated in the Perseverance rover payload. LIBS and µ-EDXRF were used to assess elemental composition and spatial distribution across the sample, whereas Raman spectroscopy confirmed the presence of mineral phases such as, olivine, pyroxenes, and chromiferous spinels in specific regions. Elemental LIBS ratios such as Mg# and Cr# further supported the identification of compositional variations related to mineral phases. Spectral LIBS data were processed using k-means clustering to segment geochemical zones and detect spatial trends. This integrated spectroscopic and statistical approach enables interpretation of ultramafic rock complexity and offers an efficient framework for planetary exploration under mission constraints.

Article Details

Volume / Issue Vol. 15, Issue 1
Published October 29, 2025
ISSN 2045-2322
Publisher Nature Portfolio

Journal Info

Scientific Reports

Nature Portfolio

ISSN: 2045-2322 Open Access Life Sciences

Authors (20)

L

Laura García-Gómez

I

Iratxe Población

T

Tomás Delgado

J

Javier Laserna

M

Marizú Velásquez

P

Pavel Pořízka

J

Jakub Buday

J

Jozef Kaiser

A

Alvaro Lobato

Department of Chemistry and Chemical Engineering, Chalmers University of Technology

A

Ana I. Casado

M

Mercedes Taravillo

J

Juan Manuel Madariaga

J

Julene Aramendia

F

Fernando Rull

Espectroscopía Raman e Infrarroja aplicado a Cosmogeoquímica y Astrobiología Research Group, Department of Applied Physics, Universidad de Valladolid

D

Daniel Carrizo

J

Jesús Martínez-Frías

I

Iñaki Vadillo

J

José Miguel Vadillo

F

Francisco J. Fortes

L

Luisa M. Cabalín