@article{PetitgirardSahleWeisetal.2019,
  author    = {Petitgirard, Sylvian and Sahle, C. J. and Weis, C. and Gilmore, K. and Spiekermann, Georg and Tse, J. S. and Wilke, Max and Cavallari, C. and Cerantola, V and Sternemann, Christian},
  title     = {Magma properties at deep Earth's conditions from electronic structure of silica},
  series = {Geochemical perspectives letters},
  volume    = {9},
  journal   = {Geochemical perspectives letters},
  publisher = {Association of Geochemistry},
  address   = {Paris},
  issn      = {2410-339X},
  doi       = {10.7185/geochemlet.1902},
  pages     = {32 -- 37},
  year      = {2019},
  abstract  = {SiO(2 )is the main component of silicate melts and thus controls their network structure and physical properties. The compressibility and viscosities of melts at depth are governed by their short range atomic and electronic structure. We measured the O K-edge and the Si L-2,L-3-edge in silica up to 110 GPa using X-ray Raman scattering spectroscopy, and found a striking match to calculated spectra based on structures from molecular dynamic simulations. Between 20 and 27 GPa, Si-[4] species are converted into a mixture of Si-[5] and Si-[6] species and between 60 and 70 GPa, Si-[6] becomes dominant at the expense of Si-[5] with no further increase up to at least 110 GPa. Coordination higher than 6 is only reached beyond 140 GPa, corroborating results from Brillouin scattering. Network modifying elements in silicate melts may shift this change in coordination to lower pressures and thus magmas could be denser than residual solids at the depth of the core-mantle boundary.},
  language  = {en}
}
@article{SpiekermannHarderGilmoreetal.2019,
  author    = {Spiekermann, Georg and Harder, M. and Gilmore, Keith and Zalden, Peter and Sahle, Christoph J. and Petitgirard, Sylvain and Wilke, Max and Biedermann, Nicole and Weis, Thomas and Morgenroth, Wolfgang and Tse, John S. and Kulik, E. and Nishiyama, Norimasa and Yava{\c{s}}, Hasan and Sternemann, Christian},
  title     = {Persistent Octahedral Coordination in Amorphous GeO₂ Up to 100 GPa by Kβ'' X-Ray Emission Spectroscopy},
  series = {Physical Review X},
  volume    = {9},
  journal   = {Physical Review X},
  number    = {1},
  publisher = {American Physical Society by the American Institute of Physics},
  address   = {Melville, NY},
  issn      = {2469-9926},
  doi       = {10.1103/PhysRevX.9.011025},
  pages     = {10},
  year      = {2019},
  abstract  = {We measure valence-to-core x-ray emission spectra of compressed crystalline GeO₂ up to 56 GPa and of amorphous GeO₂ up to 100 GPa. In a novel approach, we extract the Ge coordination number and mean Ge-O distances from the emission energy and the intensity of the Kβ'' emission line. The spectra of high-pressure polymorphs are calculated using the Bethe-Salpeter equation. Trends observed in the experimental and calculated spectra are found to match only when utilizing an octahedral model. The results reveal persistent octahedral Ge coordination with increasing distortion, similar to the compaction mechanism in the sequence of octahedrally coordinated crystalline GeO₂ high-pressure polymorphs.},
  language  = {en}
}