Data Publication

Database of Experimental and Modeling Results on Mo Transport in Sulfur-Rich Hydrothermal Fluids: Implications for Porphyry-Epithermal Cu-Au-Mo Deposits

Kokh, Maria A. | Pokrovski, Gleb | Klemme, Stephan | Schmidt, Christian | Laskar, Clément | Hazemann, Jean-Louis | Testemale, Denis | Kieffer, Isabelle | Proux, Olivier | Lachera, Eric | Müller, Harald | Bazakina, Elena | Moeller, Christoph | Ryaboshapka, Daria | Wilke, Max

GFZ Data Services

(2025)

Descriptions

We have experimentally studied the role of hydrogen sulfide (H2S and HS‒) and the trisulfur radical ion (S3•‒) in the transport of molybdenum by hydrothermal fluids at 300 °C and 500 bar as a function of pH, redox conditions and sulfur concentration. We combined solubility measurements of molybdenite in hydrothermal reactors using fluid quenching or sampling, with in situ synchrotron X-ray absorption spectroscopy experiments and thermodynamic and molecular modeling. Our solubility and spectroscopic dataset is consistent with the formation of tetrathiomolybdate complex, MoS42‒, in reduced, H2S/HS‒-dominated neutral-to-alkaline pH fluids. A mixed complex with both sulfide and trisulfur radical ion as ligands, MoS3(S3)‒, prevails in more oxidized, acidic-to-neutral pH fluids at the sulfide-sulfate coexistence where S3•‒ is abundant. In both complexes, Mo is nominally hexavalent and in a first-shell tetrahedral coordination with sulfur atoms. The derived equilibrium constants of the formal solubility reactions (log10K):
MoS2(s) + 2 H2S0(aq) + 0.5 O2(g) = MoS42‒ + 2 H+ + H2O(liq) ,
MoS2(s) + H2S0(aq) + S3•‒ + 0.5 O2(g) = MoS3(S3)‒ + H2O(liq) ,
at 300 °C and 500 bar are 0.5±0.3 and 14.6±0.5, respectively. The solubility of MoS2(s) predicted using these constants aligns well with Mo concentrations measured in natural fluid inclusions in quartz that record S-rich fluids from porphyry-epithermal systems. In contrast, other types of Mo complexes invoked so far (molybdates, alkali ion pairs, oxy-chlorides or oxysulfides) are negligible at such conditions. Thus, trisulfur radical ion complexes may be important carriers of Mo in hydrothermal fluids and would require further systematic investigation across a wide range of temperature and pressure.

The over-riding goal of the DFG priority programm 2238 - DOME (https://www.uni-potsdam.de/en/spp2238/) is to find solutions to fundamental questions of element transport and mineralization in heterogeneous chemical systems that are complex, dynamic and highly transient. The topic of ore genesis has been studied for a long time from a combined field/laboratory perspective and also experimentally in simplified systems, but rarely have these techniques been integrated in a coordinated way with the third perspective from numerical process modeling. The originality and innovation potential of this priority program lies in the coordination of empirical field-related studies that define the geological/mineralogical framework of natural ore systems with experimental work and numerical models that provide a quantitative understanding of the processes involved.

Keywords

MSL enriched keywords
ore mine
minerals
chemical elements
sulfur
measured property
sulphur
sulfide minerals
molybdenite
silicate minerals
tectosilicates
quartz
hydrogen (H)
hydrogen sulfide
molybdenum
pH
sulphate
MSL vocabulary keywords corresponding to originally assigned keywords
ore mine
Originally assigned keywords
Radical (Chemistry)
Extended X-Ray Absorption Fine Structure
X-Ray Absorption near Edge Structure
Ore Deposit
Hydrothermal Mineralization
Crustal Fluid
Molybdenum Disulfide
GEOCHEMISTRY
ELEMENTS

Metadata


MSL enriched sub domains

geochemistry

Resource Type

Dataset


Source


Source publisher

GFZ Data Services

DOI


Creators

Kokh, Maria A.
Personal
https://orcid.org/0000-0002-0855-015X
University of Münster, Münster, Germany
Pokrovski, Gleb
Personal
https://orcid.org/0000-0003-0906-1689
CNRS - Délégation Midi Pyrénées, Toulouse, France
Klemme, Stephan
Personal
https://orcid.org/0000-0001-7859-9779
University of Münster, Münster, Germany
Schmidt, Christian
Personal
https://orcid.org/0000-0003-1799-5684
GFZ Helmholtz Centre for Geosciences, Potsdam, Germany
Laskar, Clément
Personal
https://orcid.org/0000-0002-3228-6686
KU Leuven, Leuven, Belgium
Hazemann, Jean-Louis
Personal
https://orcid.org/0000-0002-3717-2151
Université Grenoble Alpes, Saint-Martin-d'Hères, France
Testemale, Denis
Personal
https://orcid.org/0000-0003-2204-5464
Université Grenoble Alpes, Saint-Martin-d'Hères, France
Kieffer, Isabelle
Personal
https://orcid.org/0000-0001-5406-6046
European Synchrotron Radiation Facility, Grenoble, France
Proux, Olivier
Personal
https://orcid.org/0000-0003-0385-1815
European Synchrotron Radiation Facility, Grenoble, France
Lachera, Eric
Personal
Institut Néel, Grenoble, France
Müller, Harald
Personal
https://orcid.org/0000-0002-0249-1646
European Synchrotron Radiation Facility, Grenoble, France
Bazakina, Elena
Personal
https://orcid.org/0000-0002-5445-2438
Helmholtz-Zentrum Dresden-Rossendorf, Dresden, Germany
Moeller, Christoph
Personal
https://orcid.org/0000-0001-7824-8004
GFZ Helmholtz Centre for Geosciences, Potsdam, Germany | University of Potsdam, Potsdam, Germany
Ryaboshapka, Daria
Personal
https://orcid.org/0000-0002-4003-1894
Institut de Recherches sur la Catalyse et l'Environnement de Lyon, Villeurbanne, France
Wilke, Max
Personal
https://orcid.org/0000-0002-1890-3940
University of Potsdam, Potsdam, Germany

Contributors

Midi-Pyrenees, CNRS Delegation
Personal
Munster, Westfalische Wilhelms-Universitat
Personal
Helmholtz-Zentrum Dresden-Rossendorf
Organizational
Universite Toulouse III Paul Sabatier
Organizational
CNES
Organizational
Alpes, CNRS Delegation
Personal
Universitat Potsdam Institut fur Geowissenschaften
Organizational
Institut de Recherche pour le Developpement Delegation Regionale Occitanie
Organizational
IGS AC at GFZ Helmholtz Centre for Geosciences
Organizational
Geosciences Environnement Toulouse
Organizational
Universite Grenoble Alpes
Organizational
ESRF (European Synchrotron Radiation Facility, Grenoble, France)
Organizational
Institut NEEL
Organizational
Institut de Recherches sur la Catalyse et l'Environnement de Lyon
Organizational
GET laboratory, (Géosciences Environnement Toulouse, Toulouse, France)
Organizational
Géosciences Environnement Toulouse, Toulouse, France
Kokh, Maria
Personal
University of Münster, Münster, Germany

Citation

Kokh, M. A., Pokrovski, G., Klemme, S., Schmidt, C., Laskar, C., Hazemann, J.-L., Testemale, D., Kieffer, I., Proux, O., Lachera, E., Müller, H., Bazakina, E., Moeller, C., Ryaboshapka, D., & Wilke, M. (2025). Database of Experimental and Modeling Results on Mo Transport in Sulfur-Rich Hydrothermal Fluids: Implications for Porphyry-Epithermal Cu-Au-Mo Deposits [Dataset]. GFZ Data Services. https://doi.org/10.5880/FIDGEO.D.2025.002


References

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Dates

Issued 2025
Updated 2026-08-24

Language

- no language entry found -


Funding References

Funder Name Agence Nationale de la Recherche
Funder Identifier https://doi.org/10.13039/501100001665
Award Number ANR-16-CE31-0017
Award Title DESY-CMWS-Early Science Project
Funder Name Institut Carnot ISIFoR
Funder Identifier https://doi.org/10.13039/501100001659
Award Number OrPet
Funder Name Institut Carnot ISIFoR
Funder Identifier https://doi.org/10.13039/501100004794
Award Number AsCOCrit
Award Title MITI interdisciplinary program Conditions Extremes 2024
Funder Name Centre National de la Recherche Scientifique
Funder Identifier https://doi.org/10.13039/501100004794
Award Number PtS3
Award Title MITI interdisciplinary programs MetalloMix 2021
Funder Name Centre National de la Recherche Scientifique
Funder Identifier https://doi.org/10.13039/501100004794
Award Number ExtremeS
Award Title Conditions Extremes 2024
Funder Name Deutsche Forschungsgemeinschaft
Funder Identifier https://doi.org/10.13039/501100001659
Award Number WI 2000/25-1
Funder Name Deutsche Forschungsgemeinschaft
Funder Identifier https://doi.org/10.13039/501100001659
Award Number KL 1368/13-1
Funder Name Deutsche Forschungsgemeinschaft
Funder Identifier https://doi.org/10.13039/501100001659
Award Number SCHM 2415/6-1
Funder Name European Synchrotron Radiation Facility
Funder Identifier https://doi.org/10.13039/501100001671
Award Number ESRF ES-1050
Funder Name European Synchrotron Radiation Facility
Funder Identifier https://doi.org/10.13039/501100001671
Award Number ESRF ES-1278
Funder Name Agence Nationale de la Recherche
Funder Identifier https://doi.org/10.13039/501100001665
Award Number PlanEx
Award Title “grand emprunt” EquipEx
Funder Name Agence Nationale de la Recherche
Funder Identifier https://doi.org/10.13039/501100001665
Award Number ANR-11-EQPX-36
Award Title “grand emprunt” EquipEx
Funder Name Deutsches Elektronen-Synchrotron
Funder Identifier https://doi.org/10.13039/501100001647
Award Title DESY-CMWS-Early Science Project

Rights

Name Creative Commons Attribution 4.0 International
URI https://creativecommons.org/licenses/by/4.0/legalcode
Identifier cc-by-4.0
Identifier Scheme SPDX
Scheme URI https://spdx.org/licenses/
Name Open access
URI http://purl.org/coar/access_right/c_abf2
Identifier c_abf2
Identifier Scheme COAR Access Rights
Scheme URI http://purl.org/coar/access_right/

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