Phosphorus Dimerization in Gallium Phosphide at High Pressure.

Title	Phosphorus Dimerization in Gallium Phosphide at High Pressure.
Authors	B. Lavina; E. Kim; H. Cynn; P.F. Weck; K. Seaborg; E. Siska; Y. Meng; W. Evans
Journal	Inorg Chem
DOI	10.1021/acs.inorgchem.7b02478
Abstract	Using combined experimental and computational approaches, we show that at 43 GPa and 1300 K gallium phosphide adopts the super- Cmcm structure, here indicated with its Pearson notation oS24. First-principles enthalpy calculations demonstrate that this structure is more thermodynamically stable above ?20 GPa than previously proposed polymorphs. In contrast to other polymorphs, the oS24 phase shows a strong bonding differentiation and distorted fivefold coordination geometries of both P atoms. The shortest bond of the phase is a single covalent P-P bond measuring 2.171(11) Å at synthesis pressure. Phosphorus dimerization in GaP sheds light on the nature of the super- Cmcm phase and provides critical new insights into the high-pressure polymorphism of octet semiconductors. Bond directionality and anisotropy explain the relatively low symmetry of this high-pressure phase.
Citation	B. Lavina; E. Kim; H. Cynn; P.F. Weck; K. Seaborg; E. Siska; Y. Meng; W. Evans.Phosphorus Dimerization in Gallium Phosphide at High Pressure.. Inorg Chem. 2018;57(5):24322437. doi:10.1021/acs.inorgchem.7b02478

Related Elements

Phosphorus

15 P 30.973762000 Phosphorus

See more Phosphorus products. Phosphorus (atomic symbol: P, atomic number: 15) is a Block P, Group 15, Period 3 element. The number of electrons in each of Phosphorus's shells is 2, 8, 5 and its electronic configuration is [Ne] 3s² 3p³. The phosphorus atom has a radius of 110.5.pm and its Van der Waals radius is 180.pm. Phosphorus is a highly-reactive non-metallic element (sometimes considered a metalloid) with two primary allotropes, white phosphorus and red phosphorus its black flaky appearance is similar to graphitic carbon. Compound forms of phosphorus include phosphates and phosphides. Phosphorous was first recognized as an element by Hennig Brand in 1669 its name (phosphorus mirabilis, or "bearer of light") was inspired from the brilliant glow emitted by its distillation.

Gallium

31 Ga 69.723000000 Gallium

See more Gallium products. Gallium (atomic symbol: Ga, atomic number: 31) is a Block P, Group 13, Period 4 element with an atomic weight of 69.723.The number of electrons in each of Gallium's shells is 2, 8, 18, 3 and its electron configuration is [Ar] 3d¹⁰ 4s² 4p¹. The gallium atom has a radius of 122.1 pm and a Van der Waals radius of 187 pm. Gallium Bohr Model Gallium was predicted by Dmitri Mendeleev in 1871. It was first discovered and isolated by Lecoq de Boisbaudran in 1875. In its elemental form, gallium has a silvery appearance. Elemental Gallium Gallium is one of three elements that occur naturally as a liquid at room temperature, the other two being mercury and cesium. Gallium does not exist as a free element in nature and is sourced commercially from bauxite and sphalerite. Currently, gallium is used in semiconductor devices for microelectronics and optics. The element name originates from the Latin word 'Gallia' referring to Gaul, the old name of France.