Large-Volume High-Pressure Phase Synthesis: 

My Long-Term Involvement With Silica 

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World's largest polycrystalline stishovite aggregate? Woo-hoo!
Photo taken from Shengnian Luo's website

Silica (SiO2) is one of the most important and well-studied systems in the Earth Sciences. Over the years I have been involved (sometimes only tangentially) in quite a few projects as a result of devising a technique for synthesizing large crystals and polycrystalline aggregates of coesite and stishovite, two of the high-pressure phases of silica. The recipe for doing this was really pioneered by Baosheng Li at Stony Brook in the early 90's, but I stumbled upon the idea independently long before I read his paper. Basically, the trick is to use a solid cylinder of silica glass as the starting material. This results in a very low-porosity final aggregate, which is desirable for a number of types of studies. Also, if you are lucky you can grow  large grains using this technique because nucleation is inhibited relative to the case of using a powdered starting material (basically grains grow in from the outside of the cylinder). Even though I am not the first author on most of the papers listed below I am quite proud of my accomplishment at having started a "cottage industry" of silica synthesis!

Projects:

1. Kinetics of the Coesite to Quartz Transformation
2. Pressure dependence of hydroxyl solubility in coesite

3. Equation of State of Coesite
4. Equation of State of Stishovite
5. Structural Refinement of Stishovite
6. High-Pressure Shock-Wave Equation of State of Stishovite
7. Deformation of Stishovite at High Pressure and Temperature

Kinetics of the Coesite to Quartz Transformation

This was the first first-author paper I published, from my thesis work. I first started playing around with silica synthesis from glass for this work and for some unpublished research on the kinetics of the reverse transition (quartz to coesite). I guess this will likely always be my most cited publication. I would let you download the pdf but unfortunately I don't have access to it, so instead the abstract is reproduced below.

Mosenfelder, J.L. , Bohlen, S.R., 1997, Kinetics of the coesite to quartz transformation. Earth and Planetary Science Letters, 153: 133-147.


The survival of coesite in ultrahigh-pressure (UHP) rocks has important implications for the exhumation of subducted crustal rocks. We have conducted experiments to study the mechanism and rate of the coesite quartz transformation using polycrystalline coesite aggregates, fabricated by devitrifying silica glass cylinders containing 2850 H/106 Si at 1000°C and 3.6 GPa for 24 h. Conditions were adjusted following synthesis to transform the samples at 700–1000°C at pressures 190–410 MPa below the quartz–coesite equilibrium boundary. Reaction proceeds via grain-boundary nucleation and interface-controlled growth, with characteristic reaction textures remarkably similar to those seen in natural UHP rocks. We infer that the experimental reaction mechanism is identical to that in nature, a prerequisite for reliable extrapolation of the rate data. Growth rates obtained by direct measurement differ by up to two orders of magnitude from those estimated by fitting a rate equation to the transformation–time data. Fitting the rates to Turnbull's equation for growth therefore yields two distinct sets of parameters with similar activation energies (242 or 269 kJ/mol) but significantly different pre-exponential constants. Extrapolation based on either set of growth rates suggests that coesite should not be preserved on geologic time scales if it reaches the quartz stability field at temperatures above 375–400°C. The survival of coesite has previously been linked to its inclusion in strong phases, such as garnet, that can sustain a high internal pressure during decompression. Other factors that may play a crucial role in preservation are low fluid availability –– possibly even less than that of our nominally "dry" experiments –– and the development of transformation stress, which inhibits nucleation and growth. These issues are discussed in the context of our experiments as well as recent observations from natural rocks.

Author Keywords: coesite; quartz; kinetics; phase transitions; high pressure

Pressure Dependence of Hydroxyl Solubility in Coesite

Mosenfelder, J.L., 2000. Pressure dependence of hydroxyl solubility in coesite. Physics and Chemistry of Minerals, 27: 610-617. Download the pdf

When I started this project I knew from my thesis work that coesite could incorporate small amounts of OH in its structure, even though measurements on natural coesite crystals failed to reveal the presence of OH. When I got to Germany I had access to much higher pressures in the multi-anvil apparatus so it seemed like a good opportunity to look systematically at the influence of pressure on the solubility of OH in this well-studied mineral. Later on Monika Koch-Mueller (then at Carnegie) improved upon and supplemented my work by doing more careful polarized IR measurements and coming up with an IR calibration for OH in coesite.

Equation of State of Coesite

Angel, R.J., Mosenfelder, J.L., Shaw, C.S.J., 2001, Anomalous compression and equation of state of coesite. Physics of the Earth and Planetary Interiors, 124: 71-79. Download the pdf

Ross Angel found out about my OH in coesite project and asked if I had any large crystals he could use for single-crystal diffraction. Extracting large (>100 micron diameter) crystals of coesite from my OH solubility experiments proved quite easy. This papers reports a new and highly precise room-temperature equation of state for coesite up to a maximum pressure of 9.6 GPa. These data should supercede previous measurements by Levien and Prewitt (1981) that were less precise in the high-pressure range. 

Equation of State of Stishovite

Andrault, D., Angel, R.J., Mosenfelder, J.L., Le Bihan, T., 2003, Equation of state of stishovite to lower mantle pressures. American Mineralogist, 88: 301-307. Download the pdf

Ross Angel did the low-pressure (<10 GPa) equation of state measurements reported in this paper on a rather large crystal of stishovite that I synthesized (ca. 400 microns long? Ross might remember). I was not really involved in the more meaty part of the paper, which entailed synchrotron X-ray diffraction experiments in a diamond-anvil cell to determine the room-temperature equation of state of stishovite to ~60 GPa and the nature of the high-pressure phase transition to a CaCl2-structured polymorph at about 60 GPa.

Structural Refinement of Stishovite

Kirfel, A., Krane, H.-G., Blaha, P., Schwarz, K., Lippman, T., 2001. Electron-density distribution in stishovite, SiO2: a new high-energy synchrotron-radiation study. Acta Crystallographica A, 57: 663-677. Download the pdf

Prof. Armin Kirfel contacted Prof. Fritz Seifert, in Bayreuth, who in turn asked me if I could synthesize some crystals for this study. I used the same trick as I did for the Andrault study and I guess it worked out. This paper reports on a very high-tech and detailed structural refinement of stishovite using synchrotron radiation. I could not confess to understand much of the physics in this one so I am very grateful that Prof. Kirfel kindly acknowledged my contribution in the paper!

High-Pressure Shock-Wave Equation of State of Stishovite

Luo, S.-N., Mosenfelder, J.L., Asimow, P.D., Ahrens, T.J., 2002. Direct shock wave loading of stishovite to 235 GPa: implications for perovskite stability relative to an oxide assemblage at lower mantle conditions. Geophysical Research Letters, 29(14): article no. 1691 Download the pdf

Luo, S.-N., Mosenfelder, J.L., Asimow, P.D., Ahrens, T.J., 2002. Stishovite and its implications in geophysics: new results from shock-wave experiments and theoretical modeling. Physics-Uspekhi, 45: 435-439

The first project I bit into at Caltech was synthesis of polycrystalline aggregates of stishovite (and coesite) for shock-wave experiments, which were conducted by Shengnian Luo. The synthesis was challenging because the minimum sample requirements for shock-wave EoS measurements (with available technology in the Caltech Shockwave lab) are dimensions of ~3mm  in diameter by 1 mm in thickness. This diameter is too large for the conventional 14/8 multi-anvil assembly that I use to obtain pressures up to 16 GPa. So I went with a minimalist approach and gutted the octahedron, dispensing with the 
ZrO2  insulating sleeve, LaCrO3 heater and MgO insulating sleeve. Instead I simply surrounded a slug of silica glass with a thin Re heater. Cranking this assembly above ~1000 °C proved problematic because without the ZrO2 insulating sleeve furnace stability was hit or miss; some runs went south in a hurry! Fortunately, fully dense and single-phase aggregates were easy to make at a temperature of 1000°C, pressure of ~14 GPa and short times (typically 45 minutes to 1 hour). With a Re heater, the temperature gradient over the sample length was probably quite high, but we didn't care so much because the goal was simply to synthesize a one-phase aggregate of the appropriate dimensions.

Deformation of Stishovite at High Pressure and Temperature

This is a project that Patrick Cordier (Lille, France) started when he was visiting BGI in the late 1990's. Patrick is a master of transmission electron microscopy and has done some very interesting characterization of dislocation microstructures using a technique called LACBED (large angle convergent beam electron diffraction) that was not previously very popular in the Earth Sciences. I showed Patrick the trick for synthesizing polycrystalline aggregates of stishovite, which he later deformed in separate experiments using the technique of employing tiny bottom and top pistons in a multi-anvil assembly. There have been a couple abstracts on the results of the work but I believe the paper is still in preparation.

I've had enough silica to last a lifetime, take me back to Jedley's homepage!