olm.USGS.PhreeqcPandas.phreeqcRunSetPCO2

olm.USGS.PhreeqcPandas.phreeqcRunSetPCO2(logPCO2, phreeqcInputFile, PHREEQC_PATH, DATABASE_FILE, newInputFile=None)[source]

Reads a PHREEQC input file, modifies it to a set PCO2 and runs the modified file.

Parameters:
phreecInputFile : str

The name of the input file to modify.

logPCO2 : float

Log10 of the PCO2 value to set the sample to.

PHREEQC_PATH : string

The path to the PHREEQC executable.

DATABASE_FILE : string

The database file to be used by PHREEQC.

newInputFile : string

The name of the set-PCO2 file to create and run. If not specified, the final 5 characters will be stripped off of phreeqcInputFile and ‘set-PCO2.phrq will be added.’

Returns
——-
simulationDict : Dict

A dictionary that contains the output of readPhreeqcOutput() run on the set PCO2 simulation.