Work Description

Title: SupPHREEQC Open Access Deposited

https://creativecommons.org/licenses/by/4.0/
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Abstract
  • SupPHREEQC is a program written in C++11, which links PHREEQC and SUPCRTBL programs to facilitate geochemical modeling at elevated temperatures and pressures suitable for clastic and carbonate diagenesis, geological carbon storage, and geothermal applications. Users could read the manuscript “SupPHREEQC: A program to generate customized PHREEQC thermodynamic databases from SUPCRTBL and extend calculations to elevated pressures and temperatures” (Zhang et al., 2019) for more details.
Description
  • Kindly report errors to Professor Chen Zhu ( supcrt@indiana.edu). Tutorials, corrections, and updates may be found at Professor Zhu’s research web site  https://hydrogeochem.earth.indiana.edu. Users of this program should also acknowledge and cite these articles: Parkhurst, D.L., Appelo, C., 2013. Description of input and examples for PHREEQC version 3--A computer program for speciation, batch-reaction, one-dimensional transport, and inverse geochemical calculations. Techniques and Methods 6-A43, U.S. Geological Survey, Reston, VA., 497. Johnson, J.W., Oelkers, E.H. and Helgeson, H.C. (1992) SUPCRT92 - A software package for calculating the standard molal thermodynamic properties of minerals, gases, aqueous species, and reactions from 1-bar to 5000-bar and 0°C to 1000°C. Computer & Geosciences 18:899-947. Zimmer, K., Zhang, Y., Lu, P., Chen, Y., Zhang, G., Dalkilic, M., Zhu, C., 2016. SUPCRTBL: A revised and extended thermodynamic dataset and software package of SUPCRT92. Computer & Geosciences 90, 97-111. This work was partly supported by NSF grant EAR-19267343 and the Office of the Vice Provost for Research of Indiana University.
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Last modified
  • 06/20/2024
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Date issued
  • 2019
To Cite this Work:
SupPHREEQC [Data set]. Indiana University - DataCORE.

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SupPHREEQC-1.9.7.zip 2024-07-20 2024-07-20 Open Access

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