Perple_X Documentation
NOTE: As of July 2011, Perple_X
6.6.6+ is the
default version of the Perple_X. An
unfortunate consequence of the change in versions is that most of the examples
and tutorials referred to here are out of date. The out-of-date examples and
tutorials are, in most cases, useful because the basic information passed
between the various programs has not changed although many of the prompts have
been eliminated or reordered.
Contents
-
Daniele Castelli
and Chiara Groppo's Perple_X (7.1.5)
tutorial for petrological problems. This tutorial consists of 13 exercises
that comprise the practical part of a 30-hour advanced course on “Petrologic
phase diagrams: principles and computations” periodically offered to PhD
students at the University of Torino.
-
Padova
phase diagram section workshop (7.1.5).
Problem and PowerPoint introduction for a shortcourse on phase diagram
sections, also covers elementary aspects of electrolytic fluid calculations
(See both Day 1 and Day 3 exercises).
-
Craig Bina's geophysical phase
diagram tutorial (20171,
partially revised 2021). Problems
relevant to mantle geophysics; modified May 2021 to include an 8th chapter on
the calculation of a mantle adiabat. This tutorial may be usefully combined with the
Perple_X
phase diagram section and extraction of rock
properties along a path tutorials.
-
Jesse
Walter's metapelite phase diagram section tutorial (revised
20171). Guides the reader through a phase diagram section
calculation with explanatory commentary.
-
Lausanne
metacarbonate workshop (20161,2).
Problems for the practical of a 2-day course on meta-carbonate + COH-fluid
phase equilibria.
-
Dave Hirsch's Perple_X
petrological phase diagram tutorial (revised 20141,2).
Phase diagram calculations (composition diagrams, sections, and projections)
relevant to metamorphic petrologists. This tutorial is slightly
out-of-date, and was written primarily for Mac OSX
users; for WINDOWS users some lateral thinking may be required. This tutorial may be
usefully combined with the Perple_X
phase diagram section and, very
out-of-date, composition and
Schreinemakers diagram tutorials.
-
Mark Caddick's files for
the 2-day C2C Workshop on calculating phase diagram sections with Perple_X
(20091,2)
- this is not really a tutorial (for that you need Mark), but the PowerPoint presentations
and exercises (see the 2nd PowerPoint presentation) may be useful teaching aids
(to browse the files follow this
link).
-
The Perple_X
tutorial (revised 20002)
This tutorial
is not current, so prompts and results obtained
now with Perple_X may differ from those in
the documentation. The tutorial may still be useful for learning how
to use Perple_X for classical petrological
phase diagram constructions (chemographies, phase diagram projections, and
isopotential phase diagram sections).
1As of the 6.8.6 revision
(January 24, 2019), the auto_refine_factor_X (X = I..III) options have been made
redundant by the specification of an auto-refine stage value in the
initial_resolution option. To implement changes to the auto_refine_factor_X
suggested in these notes in the current version of Perple_X,
set the second value of the initial_resolution option equal to the
old_initial_resolution/auto_refine_factor_X, where old_initial_resolution is the
value of initial_resolution used in the notes.
2As of the 6.7.4 revision
(July 11, 2017), calculations of chemographies, iso-potential phase diagram
sections, and Schreinemakers projections using Perple_X's
original convexhull optimization strategy are done in the program CONVEX rather
than in the program VERTEX as is suggested in these notes. If the current
version of VERTEX is used for such a calculation, the user is automatically
directed to use CONVEX.
Option files:
Data files:
How Perple_X works:
Tutorials:
Miscellanea:
Flow charts of program structure:
Neither of the pages linked below is updated frequently, it is probably more useful to
browse perplex/examples.
The original technical documentation (vdoc.pdf)
is a potpourri of different kinds of information on topics
such as the equations of state implemented in Perple_X
for compounds and solutions and the structure of various Perple_X
data files. The technical documentation is not up-to-date and it is not a useful document for Perple_X novices.
Plotting WERAMI (tab/phm file) output:
Utilities to facilitate running Perple_X:
Mineral Physics:
Petrology:
Geophysics,
Geodynamics, Astrophysics:
Miscellanea:
Scripts for pre-6.6.6 versions of Perple_X:
Perple_X 07:
-
autoVertex - an OSX/Unix perl script that automates running VERTEX. This script is
obsolete, but provides
a template for scripts to perform other tasks.
Perple_X 06:
These are notes prepared, with emphasis on elementary, for short
courses some decades ago. The first part deals with some basic thermodynamic principles,
especially G-X diagrams. The second part offers a brief out-of-date comparison
of computational methods, and elaborates on aspects of Perple_X algorithms.
-
Connolly JAD, Galvez ME (2018) Electrolytic
fluid speciation by Gibbs energy minimization and implications for
subduction zone mass transfer. Earth and Planetary Science Letters 501:1-13
doi: 10.1016/ j.epsl.2018.08.024
-
Connolly JAD (2017) A
Primer in Gibbs Energy Minimization for Geophysicists. Petrology
25:526-534 doi:10.1134/s0869591117050034
-
Connolly JAD (2016) Liquid-vapor
phase relations in the Si-O system: A calorically constrained van der
Waals-type model. Journal of
Geophysical Research-Planets 121:1641-1666 doi:10.1002/2016JE005059
-
Helffrich G, Connolly JAD (2009) Physical contradictions and remedies using simple polythermal equations of state.
American Mineralogist 94:1616-1619, doi:10.2138/am.2009.3262
-
Connolly, JAD (2009) The
geodynamic equation of state: what and how.
Geochemistry Geophysics Geosystems, 10:Q10014,
doi:10.1029/2009GC002540
-
Connolly JAD (2005)
Computation of phase equilibria by linear
programming: a tool for geodynamic modeling and its application to subduction
zone decarbonation. EPSL 236:524–541 (Errata)
-
Connolly JAD, Kerrick DM (2002)
Metamorphic controls on seismic velocity of subducted oceanic crust at 100-250
km depth.
EPSL 204:61-74
-
Connolly JAD, Petrini K (2002)
An automated strategy for calculation
of phase diagram sections and retrieval of rock properties as a function
of physical conditions.
J Met Geol, 20:697-708. (Errata)
-
Connolly JAD (1995) Phase
diagram methods for graphitic rocks and application to the system C-O-H-FeO-TiO2-SiO2.
Contrib Mineral Petrol 119:94-116 (Errata)
-
Connolly JAD, Cesare B (1993) C-O-H-S
fluid composition and oxygen fugacity in graphitic metapelites. J
Metamorphic Geol 11:368-378 (Errata)
-
Abart R, Connolly JAD, Trommsdorff V (1992) Singular
point analysis: construction of Schreinemakers projections for systems
with a binary solution. Am J Sci 292:778-805
-
Connolly JAD, Trommsdorff V (1991) Petrogenetic grids for metacarbonate
rocks: pressure-temperature phase diagrams for mixed volatile systems. Contrib
Mineral Petrol 108: 93-105
-
Connolly JAD (1990) Multivariable
phase diagrams: an algorithm based on generalized thermodynamics. Am
J Sci 290:666-718 (Errata)
-
Connolly JAD, Kerrick DM (1987) An
algorithm and computer program for calculating composition phase diagrams.
CALPHAD 11:1-55
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