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Materials Data on Te(NO3)2 by Materials Project

Te(NO3)2 crystallizes in the monoclinic C2/m space group. The structure is one-dimensional and consists of two Te(NO3)2 ribbons oriented in the (0, 1, 0) direction. N4+ is bonded in a distorted single-bond geometry to three O2- atoms. There is one shorter (1.14 Å) and two longer (2.05 Å) N–O bond length. Te4+ is bonded in a square co-planar geometry to four equivalent O2- atoms. All Te–O bond lengths are 1.89 Å. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a bent 120 degrees geometry to one N4+ and one Te4+ atom. In the second O2- site, O2- is bonded in a single-bond geometry to one N4+ atom.

36 MATERIALS SCIENCE↗

Materials Data on TeNO4 by Materials Project

NTeO4 crystallizes in the triclinic P-1 space group. The structure is one-dimensional and consists of one NTeO4 ribbon oriented in the (1, 0, 0) direction. N is bonded in a distorted water-like geometry to two O atoms. There is one shorter (1.15 Å) and one longer (1.91 Å) N–O bond length. Te is bonded to five O atoms to form distorted edge-sharing TeO5 trigonal bipyramids. There are a spread of Te–O bond distances ranging from 1.89–2.06 Å. There are four inequivalent O sites. In the first O site, O is bonded in a bent 120 degrees geometry to one N and one Te atom. In the second O site, O is bonded in a water-like geometry to two equivalent Te atoms. In the third O site, O is bonded in a water-like geometry to two equivalent Te atoms. In the fourth O site, O is bonded in a single-bond geometry to one N atom.

36 MATERIALS SCIENCE↗

Materials Data on Te2NO6 by Materials Project

N2(TeO3)4 crystallizes in the orthorhombic Pnma space group. The structure is two-dimensional and consists of four ammonia molecules and two TeO3 sheets oriented in the (0, 0, 1) direction. In each TeO3 sheet, there are two inequivalent Te sites. In the first Te site, Te is bonded to five O atoms to form distorted corner-sharing TeO5 trigonal bipyramids. The corner-sharing octahedra tilt angles range from 39–41°. There are a spread of Te–O bond distances ranging from 1.79–1.97 Å. In the second Te site, Te is bonded to six O atoms to form TeO6 octahedra that share corners with two equivalent TeO6 octahedra and corners with four equivalent TeO5 trigonal bipyramids. The corner-sharing octahedral tilt angles are 49°. There is three shorter (1.95 Å) and three longer (1.96 Å) Te–O bond length. There are four inequivalent O sites. In the first O site, O is bonded in a single-bond geometry to one Te atom. In the second O site, O is bonded in a bent 120 degrees geometry to two equivalent Te atoms. In the third O site, O is bonded in a bent 150 degrees geometry to two Te atoms. In the fourth O site, O is bonded in a bent 150 degrees geometry to two Te atoms.

36 MATERIALS SCIENCE↗

Materials Data on Te2N2O7 by Materials Project

N2Te2O7 crystallizes in the monoclinic P2_1/c space group. The structure is one-dimensional and consists of two N2Te2O7 ribbons oriented in the (1, 0, 0) direction. there are two inequivalent N1+ sites. In the first N1+ site, N1+ is bonded in a bent 120 degrees geometry to two O2- atoms. There is one shorter (1.21 Å) and one longer (1.36 Å) N–O bond length. In the second N1+ site, N1+ is bonded in a water-like geometry to two O2- atoms. There is one shorter (1.20 Å) and one longer (1.41 Å) N–O bond length. There are two inequivalent Te6+ sites. In the first Te6+ site, Te6+ is bonded in a distorted rectangular see-saw-like geometry to four O2- atoms. There are a spread of Te–O bond distances ranging from 1.93–2.30 Å. In the second Te6+ site, Te6+ is bonded in a distorted rectangular see-saw-like geometry to four O2- atoms. There are a spread of Te–O bond distances ranging from 1.93–2.18 Å. There are seven inequivalent O2- sites. In the first O2- site, O2- is bonded in a single-bond geometry to one N1+ atom. In the second O2- site, O2- is bonded in a bent 150 degrees geometry to two Te6+ atoms. In the third O2- site, O2- is bonded in a bent 120 degrees geometry to one N1+ and one Te6+ atom. In the fourth O2- site, O2- is bonded in a water-like geometry to two Te6+ atoms. In the fifth O2- site, O2- is bonded in a single-bond geometry to one N1+ atom. In the sixth O2- site, O2- is bonded in a 2-coordinate geometry to one N1+ and one Te6+ atom. In the seventh O2- site, O2- is bonded in a water-like geometry to two Te6+ atoms.

36 MATERIALS SCIENCE↗

Materials Data on Te2NO7 by Materials Project

NO3(TeO2)2 crystallizes in the orthorhombic Pnma space group. The structure is two-dimensional and consists of four nitric acid molecules and two TeO2 sheets oriented in the (0, 0, 1) direction. In each TeO2 sheet, Te is bonded in a distorted rectangular see-saw-like geometry to four O atoms. There are a spread of Te–O bond distances ranging from 1.92–2.15 Å. There are three inequivalent O sites. In the first O site, O is bonded in a water-like geometry to two equivalent Te atoms. In the second O site, O is bonded in a bent 120 degrees geometry to two equivalent Te atoms. In the third O site, O is bonded in a water-like geometry to two equivalent Te atoms.

36 MATERIALS SCIENCE↗