[Rphree-general] Rphree:AddProp function. Are "PURE" and "EQUILIBRIUM_PHASES" the same?

[Oleg Ishkov]

I am very sorry. My mistake, found that PURE=EQUILIBRIUM_PHASES.


As an suggestion, shall we add may be in
AddProp l21:
markpure <- grep("PURE", input)

something like
markpure <- grep("PURE|EQUILIBRIUM|EQUILIBRIA|PURE_PHASES|PURE", input) ?

Sorry for the inconvenience.


Best regards,
Oleg

From: Oleg Ishkov
Sent: 02 June 2014 15:21
To: 'rphree-general at lists.r-forge.r-project.org'
Subject: Rphree:AddProp function. Are "PURE" and "EQUILIBRIUM_PHASES" the same?

Dear Marco,

I noticed that function AddProp looks for "PURE" string sequence [line 21: markpure <- grep("PURE", input) ] to mark a place where to insert a new property.

Could you please let me know am I understand it right that "Pure" and "EQUILIBRIUM_PHASES" are the same keywords?
I checked manual for PHREEQC and there is no PURE keyword (PHREEQC v3).

Thank you!

Best regards,
Oleg


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