VGP14C:
Using Computational Thermodynamics to Model Natural Systems: Recent Advances and Challenges for the Future II Posters

Submit an Abstract to this Session

Session ID#: 6078

Session Description:
Computational thermodynamic modelling has become a mainstay research tool and complex chemical equilibria can now be calculated in systems of geological interest. Results of such calculations are frequently employed in igneous petrology to determine the fusion and crystallization paths followed by magmas, in metamorphic petrology to estimate the equilibrium temperature and pressure of mineral assemblages, and in geochemistry to assess fluid-rock interactions, amongst others. This session seeks to bring together researchers involved in the experimental determination or optimization of phase diagrams and physical and thermodynamic properties of melts, minerals and fluids, as well as their users in the full diversity of natural and industrial applications of such data and models. Contributions linked to the development of (internally-consistent) thermodynamic databases and software are also very welcome.
OSPA Liaison:  Vincent van Hinsberg, McGill University, Dept of Earth and Planetary Sciences, Montreal, QC, Canada
Chairs:  Vincent van Hinsberg1, Manas Paliwal2 and Jean-Philippe Harvey1, (1)McGill University, Dept of Earth and Planetary Sciences, Montreal, QC, Canada(2)McGill University, Mining and Materials Engineering, Montreal, QC, Canada
Primary Convener:  Vincent van Hinsberg, McGill University, Dept of Earth and Planetary Sciences, Montreal, QC, Canada
Conveners:  Manas Paliwal, McGill University, Mining and Materials Engineering, Montreal, QC, Canada and Jean-Philippe Harvey, McGill University, Mining and Materials Engineering, Montreal, QC, Canada
Index Terms:

1011 Thermodynamics [GEOCHEMISTRY]
3612 Reactions and phase equilibria [MINERALOGY AND PETROLOGY]
3630 Experimental mineralogy and petrology [MINERALOGY AND PETROLOGY]
3919 Equations of state [MINERAL PHYSICS]
Co-Sponsor(s):
  • EP - Element Partitioning and Mobility
  • MS - Mineral Structure, Surfaces, and Crystallography

Abstracts Submitted to this Session:

 
Thermodynamic modeling of the Li2O-Na2O-Al2O3-SiO2 system under atmospheric pressure (33573)
Bikram Konar, Pierre Hudon, Marie-Aline Van Ende and In-Ho Jung, McGill University, Montreal, QC, Canada
 
TCInvestigator: Automated Calculation of Contours for THERMOCALC Pseudosections (34744)
Mark A Pearce1,2, Alistair White3 and Michael F Gazley3, (1)CSIRO Mineral Resources, Perth, Australia, (2)Curtin University, Department of Applied Geology, Perth, Australia, (3)CSIRO Mineral Resources Flagship, Perth, Australia
 
Thermodynamic Properties of Dilute Aqueous Electrolytes and Non-Electrolytes at Elevated Temperatures, from Molecular Dynamics Simulations (34810)
Matthew Steele-MacInnis1, Denis Zezin2, Noah Bieler2, Philippe Hünenberger2 and Thomas Driesner2, (1)University of Alberta, Earth and Atmospheric Sciences, Edmonton, AB, Canada, (2)ETH Zurich, Zurich, Switzerland
 
How to choose solution models for phase equilibria modeling of migmatitic metapelites? (35680)
Pierre-Henri Trapy and Felix Gervais, Ecole Polytechnique de Montréal, Département des génies civil, géologique et des mines., Montréal, QC, Canada
 
Multicomponent Diffusion Modelling Applied to the Sudbury Igneous Complex (36769)
Quincy M C Poon1, James E. Mungall2 and Kirill Kompaniets1, (1)University of Toronto, Earth Sciences, Toronto, ON, Canada, (2)University of Toronto, Department of Earth Science, Toronto, ON, Canada