We report on the synthesis and high pressure behavior of three polymorphs of SrGeO. At ambient pressure, SrGeO crystallizes in the monoclinic structure pseudo-wollastonite. Two high pressure polymorphs, triclinic walstromite, and cubic perovskite were synthesized using a large volume multi-anvil press. The crystal structures of the three polymorphs were investigated with powder X-ray diffraction as a function of pressure using diamond anvil cells. It was found that the pseudo-wollastonite polymorph becomes amorphous at 10 GPa and equation of state fitting of the volume data yielded a bulk modulus of K = 47(4) GPa, reported for the first time. Compression of the walstromite structure showed the structure to be very compressible with two distinct phase transitions at around 10-12 GPa and 35-38 GPa. The data suggest that the structure then becomes amorphous although it retains a small degree of long-range order to the highest pressure studied. The perovskite polymorph was very incompressible and equation of state fitting of the volume data yielded a high bulk modulus of K = 194(3) GPa. All the experimental data was compared to density functional theory calculations, which were observed to fit well with the experiments.

High pressure structure studies of three SrGeO3 polymorphs - Amorphization under pressure

Ceresoli Davide;
2021

Abstract

We report on the synthesis and high pressure behavior of three polymorphs of SrGeO. At ambient pressure, SrGeO crystallizes in the monoclinic structure pseudo-wollastonite. Two high pressure polymorphs, triclinic walstromite, and cubic perovskite were synthesized using a large volume multi-anvil press. The crystal structures of the three polymorphs were investigated with powder X-ray diffraction as a function of pressure using diamond anvil cells. It was found that the pseudo-wollastonite polymorph becomes amorphous at 10 GPa and equation of state fitting of the volume data yielded a bulk modulus of K = 47(4) GPa, reported for the first time. Compression of the walstromite structure showed the structure to be very compressible with two distinct phase transitions at around 10-12 GPa and 35-38 GPa. The data suggest that the structure then becomes amorphous although it retains a small degree of long-range order to the highest pressure studied. The perovskite polymorph was very incompressible and equation of state fitting of the volume data yielded a high bulk modulus of K = 194(3) GPa. All the experimental data was compared to density functional theory calculations, which were observed to fit well with the experiments.
2021
Istituto di Scienze e Tecnologie Chimiche "Giulio Natta" - SCITEC
Diamond anvil cell
High pressure
Perovskite
Polymorphism
Pseudo-wollastonite
Walstromite
File in questo prodotto:
File Dimensione Formato  
prod_459006-doc_178580.pdf

solo utenti autorizzati

Descrizione: High pressure structure studies of three SrGeO3 polymorphs - Amorphization under pressur
Tipologia: Versione Editoriale (PDF)
Licenza: NON PUBBLICO - Accesso privato/ristretto
Dimensione 2.7 MB
Formato Adobe PDF
2.7 MB Adobe PDF   Visualizza/Apri   Richiedi una copia

I documenti in IRIS sono protetti da copyright e tutti i diritti sono riservati, salvo diversa indicazione.

Utilizza questo identificativo per citare o creare un link a questo documento: https://hdl.handle.net/20.500.14243/430094
Citazioni
  • ???jsp.display-item.citation.pmc??? ND
  • Scopus 5
  • ???jsp.display-item.citation.isi??? ND
social impact