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41 records · Page 3
All sourcesNASA NTRSDOE OSTI
DOE OSTI2020

Materials Data on RbMnP by Materials Project

RbMnP crystallizes in the tetragonal P4/nmm space group. The structure is two-dimensional and consists of one RbMnP sheet oriented in the (0, 0, 1) direction. Rb1+ is bonded in a 4-coordinate geometry to four equivalent P3- atoms. All Rb–P bond lengths are 3.40 Å. Mn2+ is bonded to four equivalent P3- atoms to form a mixture of edge and corner-sharing MnP4 tetrahedra. All Mn–P bond lengths are 2.27 Å. P3- is bonded in a 4-coordinate geometry to four equivalent Rb1+ and four equivalent Mn2+ atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on MnP by Materials Project

MnP is Zincblende, Sphalerite structured and crystallizes in the cubic F-43m space group. The structure is three-dimensional. Mn2+ is bonded to four equivalent P2- atoms to form corner-sharing MnP4 tetrahedra. All Mn–P bond lengths are 2.28 Å. P2- is bonded to four equivalent Mn2+ atoms to form corner-sharing PMn4 tetrahedra.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on TiMnP by Materials Project

TiMnP crystallizes in the hexagonal P-62m space group. The structure is three-dimensional. Ti is bonded in a 5-coordinate geometry to five P atoms. There are four shorter (2.52 Å) and one longer (2.55 Å) Ti–P bond lengths. Mn is bonded to four P atoms to form a mixture of distorted edge and corner-sharing MnP4 tetrahedra. There are two shorter (2.28 Å) and two longer (2.38 Å) Mn–P bond lengths. There are two inequivalent P sites. In the first P site, P is bonded in a 9-coordinate geometry to three equivalent Ti and six equivalent Mn atoms. In the second P site, P is bonded in a 9-coordinate geometry to six equivalent Ti and three equivalent Mn atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on CsMnP by Materials Project

CsMnP crystallizes in the tetragonal P4/nmm space group. The structure is two-dimensional and consists of one CsMnP sheet oriented in the (0, 0, 1) direction. Cs1+ is bonded in a 4-coordinate geometry to four equivalent P3- atoms. All Cs–P bond lengths are 3.51 Å. Mn2+ is bonded to four equivalent P3- atoms to form a mixture of edge and corner-sharing MnP4 tetrahedra. All Mn–P bond lengths are 2.28 Å. P3- is bonded in a 4-coordinate geometry to four equivalent Cs1+ and four equivalent Mn2+ atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on HfMnP by Materials Project

HfMnP crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Hf is bonded in a 5-coordinate geometry to five equivalent P atoms. There are a spread of Hf–P bond distances ranging from 2.64–2.71 Å. Mn is bonded to four equivalent P atoms to form a mixture of distorted corner and edge-sharing MnP4 tetrahedra. There are a spread of Mn–P bond distances ranging from 2.37–2.47 Å. P is bonded in a 9-coordinate geometry to five equivalent Hf and four equivalent Mn atoms.

36 MATERIALS SCIENCE↗