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In this study the first in situ high-pressure single-crystal X-ray diffraction experiments at Xpress, the Indo-Italian beamline of the Elettra synchrotron, Trieste (Italy), are reported. A description of the beamline experimental setup and of the procedures for single-crystal centring, data collection and processing, using diamond anvil cells, are provided. High-pressure experiments on a synthetic crystal of clinoenstatite (MgSiO3), CaCO3 polymorphs and a natural sample of leucophoenicite [Mn7Si3O12(OH)2] validated the suitability of the beamline experimental setup to: (i) locate and characterize pressure-induced phase transitions; (ii) solve ab initio the crystal structure of high-pressure polymorphs; (iii) perform fine structural analyses at the atomic scale as a function of pressure; (iv) disclose complex symmetry and structural features undetected using conventional X-ray sources.

Supporting information

cif

Crystallographic Information File (CIF) https://doi.org/10.1107/S1600577519015170/ig5082sup1.cif
Contains datablock I

hkl

Structure factor file (CIF format) https://doi.org/10.1107/S1600577519015170/ig5082sup2.hkl
Contains datablocks calcite_siliconoil_ambientpressure, calcite-II_siliconoil_1.77GPa, calcite-III_siliconoil_2.69GPa

hkl

Structure factor file (CIF format) https://doi.org/10.1107/S1600577519015170/ig5082sup3.hkl
Contains datablocks clinoenstatite_Ne_0.41GPa, clinoenstatite_Ne_1.08GPa, clinoenstatite_Ne_3.03GPa, clinoenstatite_Ne_3.93GPa, clinoenstatite_Ne_7.37GPa, clinoenstatite_Ne_10.17GPa, clinoenstatite_Ne_14.49GPa, clinoenstatite_Ne_15.95GPa, clinoenstatite_Ne_17.38GPa

hkl

Structure factor file (CIF format) https://doi.org/10.1107/S1600577519015170/ig5082sup4.hkl
Contains datablock clinoenstatite_Ne_0.41GPa

CCDC reference: 1965027

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