Material Properties Data and References

Material Properties Data and References

This site collects information for development of open-access databases/repositories related to material properties under varying pressures and temperatures. Target audiences are the materials high pressure communities in geosciences, physics, and engineering and the planetary impact processes communities.

Overview of Open Science High-Pressure Material Properties Database Initiative June 2023

Link to HPEOS database technical description and materials for discussion at APS SCCM Meeting, June 2023:

Database design specifications, example MongoDB database, example metadata:

https://ucdavis.box.com/s/cpx4b6zv1whfwmn1kzm9td1l49euqjv3

Previous presentations

Presentation Slides ‘Open Science Opportunities and Challenges for theHigh-Pressure Community’ by S. T. Stewart, CMAP Group Meeting, January 20, 2023

If you are interested in participating/supporting high-pressure materials open science initiatives, please email Sarah (ststewart at ucdavis.edu).

Shorter presentation at NIF/JLF User Meeting 2/22/23:

What kinds of data are desired for these communities?

For minerals and rocks/ices and melts/fluids properties desired in open access repos:

  • Equations of state (P-V-T): static, dynamic lab data and ab initio calculations; phase diagrams
  • Thermophysical properties: heat capacities, electrical and thermal conductivities, Grueneisen parameters, thermal expansion, sound speeds; opacities
  • Crystallography: structure parameters, elastic and shear moduli
  • Spectroscopic/optical properties: absorption/transmission spectra; index of refraction; pressure range for transparency under shock or ramp
  • Magnetic properties
  • Rheological properties: (quasi-static) failure; HEL; viscosity; fragmentation
  • Mixtures/compounds: mixture theory; phase diagrams; porosity?

In progress below:

  • collect available databases and references for material properties (emphasis on geo-materials and lab standards)
  • Collect information about open access standards and initiatives
  • Explore other examples of database structures and data format standards:
    • XML format examples below (thermoML; chem CXML)
    • JSON format also used for no-SQL databases. E.g. MongoDB in materialsproject.org

(not including superconductors, organic materials,….)

Please submit additional resources or corrections via our submission form

Material Properties References (geo to plasmas)

NameTagsURL
BookGeo
BookGeo
Digital-dataGeo
ThermoGeo
Book
Thermo
ThermoClathratesLiquidsAlloysOrganics
ThermoDesktop-softwareDigital-data
Spectra-optical-propsGeo
Spectra-optical-propsGeo
Spectra-optical-props
Spectra-optical-propsGeo
Spectra-optical-propsGeoMinerals
BookGeo
Book
Book
Book
ThermoDesktop-software
GeoMinerals
Ab initio
Ab initio
Ab initioGeo
Ab initioDOE
Ab initioDOENSFONR
Book
Alloys
Inorganic
Nuclear
Restricted-licensed
BookDigital-dataGeo
Digital-data
GeoRestricted-licensed
X-ray
Digital-dataThermo
Desktop-softwareThermo
Desktop-softwareAb initioNSF
Ab initioCodes
Ab initio
X-ray
X-ray
X-ray
Desktop-software
Spectra-optical-propsBook
ThermoCodesGeoDigital-dataNSF
ThermoGeoAqueousDigital-dataCodesNSF
GeoDigital-dataNSF
Spectra-optical-propsGeoDigital-dataNASAMinerals
Spectra-optical-propsX-rayDigital-dataNASAGeoMinerals
BookSpectra-optical-propsMinerals
BookSpectra-optical-propsMinerals
CrystallographyNSFMinerals
CrystallographyDigital-dataOpen-repo
CrystallographyDigital-data
GeoDigital-dataMinerals
MineralsThermoAb initio
GeoMinerals
GeoCrystallographyMinerals
GeoMinerals
GeoMinerals
GeoMinerals
MineralsGeoCrystallographyE-book
MineralsSpectra-optical-propsGeo
Spectra-optical-props
AlloysThermoBookSubscription
ThermoSubscription
ThermoDigital-dataNMRSubscription
ThermoSubscription
GeoThermo
BookGeoThermo
GeoDesktop-softwareThermoOpen-repoMineral-systems
GeoThermoOpen-repoMineral-systems
GeoThermoOpen-repoMineral-systems
E-bookGeoMineralsRheology
Shock
BookMineralsGeo
BookE-bookGeo
AqueousLiquidsGeo
GeoMeteorites
Example data initiatives in other fields