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Search indexed NASA NTRS and DOE OSTI research on propulsion, heat transfer, battery materials and energy systems. Follow report and document links to the original sources.

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At least 19 records
All sourcesNASA NTRSDOE OSTI
DOE OSTI2020

Materials Data on S7(N3O4)2 by Materials Project

S7(N3O4)2 crystallizes in the tetragonal P-42_1m space group. The structure is zero-dimensional and consists of two S7(N3O4)2 clusters. there are two inequivalent N5+ sites. In the first N5+ site, N5+ is bonded in a bent 120 degrees geometry to two S2- atoms. There is one shorter (1.55 Å) and one longer (1.65 Å) N–S bond length. In the second N5+ site, N5+ is bonded in a trigonal planar geometry to three S2- atoms. There is one shorter (1.69 Å) and two longer (1.75 Å) N–S bond length. There are three inequivalent S2- sites. In the first S2- site, S2- is bonded in a water-like geometry to two equivalent N5+ atoms. In the second S2- site, S2- is bonded to two N5+ and two O2- atoms to form corner-sharing SN2O2 tetrahedra. Both S–O bond lengths are 1.43 Å. In the third S2- site, S2- is bonded in a bent 120 degrees geometry to two equivalent N5+ atoms. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a single-bond geometry to one S2- atom. In the second O2- site, O2- is bonded in a single-bond geometry to one S2- atom.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on S3N2O5 by Materials Project

N2SS2O5 crystallizes in the monoclinic P2_1/c space group. The structure is zero-dimensional and consists of eight ammonia molecules, four hydrogen sulfide molecules, and four sulfino hydrogen sulfite molecules.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on S3(NO)2 by Materials Project

S3(NO)2 crystallizes in the monoclinic C2/c space group. The structure is zero-dimensional and consists of four S3(NO)2 clusters. N5+ is bonded in a bent 120 degrees geometry to two S2- atoms. There is one shorter (1.55 Å) and one longer (1.64 Å) N–S bond length. There are two inequivalent S2- sites. In the first S2- site, S2- is bonded in a bent 120 degrees geometry to one N5+ and one O2- atom. The S–O bond length is 1.48 Å. In the second S2- site, S2- is bonded in a water-like geometry to two equivalent N5+ atoms. O2- is bonded in a single-bond geometry to one S2- atom.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on S2N2O by Materials Project

N2S2O is alpha structured and crystallizes in the monoclinic P2_1/c space group. The structure is zero-dimensional and consists of four N2S2O clusters. there are four inequivalent N3+ sites. In the first N3+ site, N3+ is bonded in a bent 120 degrees geometry to two S2- atoms. There is one shorter (1.58 Å) and one longer (1.63 Å) N–S bond length. In the second N3+ site, N3+ is bonded in a bent 150 degrees geometry to two S2- atoms. There is one shorter (1.57 Å) and one longer (1.59 Å) N–S bond length. In the third N3+ site, N3+ is bonded in a bent 150 degrees geometry to two S2- atoms. There is one shorter (1.57 Å) and one longer (1.59 Å) N–S bond length. In the fourth N3+ site, N3+ is bonded in a bent 120 degrees geometry to two S2- atoms. There is one shorter (1.57 Å) and one longer (1.63 Å) N–S bond length. There are four inequivalent S2- sites. In the first S2- site, S2- is bonded in a tetrahedral geometry to two N3+ and two O2- atoms. There is one shorter (1.44 Å) and one longer (1.45 Å) S–O bond length. In the second S2- site, S2- is bonded in a bent 120 degrees geometry to two N3+ atoms. In the third S2- site, S2- is bonded in a distorted bent 120 degrees geometry to two N3+ atoms. In the fourth S2- site, S2- is bonded in a bent 120 degrees geometry to two N3+ atoms. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a single-bond geometry to one S2- atom. In the second O2- site, O2- is bonded in a single-bond geometry to one S2- atom.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on S5N4O3 by Materials Project

N4S5O3 crystallizes in the monoclinic P2_1/c space group. The structure is zero-dimensional and consists of four N4S5O3 clusters. there are four inequivalent N4+ sites. In the first N4+ site, N4+ is bonded in a bent 150 degrees geometry to two S2- atoms. There is one shorter (1.56 Å) and one longer (1.59 Å) N–S bond length. In the second N4+ site, N4+ is bonded in a trigonal planar geometry to three S2- atoms. There is two shorter (1.67 Å) and one longer (1.83 Å) N–S bond length. In the third N4+ site, N4+ is bonded in a bent 150 degrees geometry to two S2- atoms. There is one shorter (1.56 Å) and one longer (1.60 Å) N–S bond length. In the fourth N4+ site, N4+ is bonded in a bent 150 degrees geometry to two S2- atoms. Both N–S bond lengths are 1.59 Å. There are five inequivalent S2- sites. In the first S2- site, S2- is bonded in a distorted water-like geometry to two N4+ atoms. In the second S2- site, S2- is bonded in a distorted bent 120 degrees geometry to two N4+ atoms. In the third S2- site, S2- is bonded in a bent 120 degrees geometry to two N4+ atoms. In the fourth S2- site, S2- is bonded in a water-like geometry to two N4+ atoms. In the fifth S2- site, S2- is bonded in a distorted tetrahedral geometry to one N4+ and three O2- atoms. There is one shorter (1.45 Å) and two longer (1.46 Å) S–O bond length. There are three inequivalent O2- sites. In the first O2- site, O2- is bonded in a single-bond geometry to one S2- atom. In the second O2- site, O2- is bonded in a single-bond geometry to one S2- atom. In the third O2- site, O2- is bonded in a single-bond geometry to one S2- atom.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on S3(NO7)2 by Materials Project

(NO2)2S3O10 crystallizes in the monoclinic Cc space group. The structure is zero-dimensional and consists of eight hydroxylamine, n-hydroxy- molecules and four trisulfuric acid molecules.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on S4N4O3 by Materials Project

N3S4NO3 crystallizes in the monoclinic P2_1/c space group. The structure is zero-dimensional and consists of four nitric acid molecules and four N3S4 clusters. In each N3S4 cluster, there are three inequivalent N+3.50+ sites. In the first N+3.50+ site, N+3.50+ is bonded in a bent 150 degrees geometry to two S2- atoms. There is one shorter (1.55 Å) and one longer (1.57 Å) N–S bond length. In the second N+3.50+ site, N+3.50+ is bonded in a distorted bent 150 degrees geometry to two S2- atoms. There is one shorter (1.58 Å) and one longer (1.59 Å) N–S bond length. In the third N+3.50+ site, N+3.50+ is bonded in a bent 150 degrees geometry to two S2- atoms. There is one shorter (1.55 Å) and one longer (1.57 Å) N–S bond length. There are four inequivalent S2- sites. In the first S2- site, S2- is bonded in a 1-coordinate geometry to one N+3.50+ atom. In the second S2- site, S2- is bonded in a bent 120 degrees geometry to two N+3.50+ atoms. In the third S2- site, S2- is bonded in a bent 120 degrees geometry to two N+3.50+ atoms. In the fourth S2- site, S2- is bonded in a distorted single-bond geometry to one N+3.50+ atom.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on S2NO by Materials Project

ONS2 crystallizes in the triclinic P-1 space group. The structure is zero-dimensional and consists of four ONS2 clusters. In two of the ONS2 clusters, N2- is bonded in a bent 120 degrees geometry to two S2+ atoms. There is one shorter (1.55 Å) and one longer (1.67 Å) N–S bond length. There are two inequivalent S2+ sites. In the first S2+ site, S2+ is bonded in a single-bond geometry to one N2- atom. In the second S2+ site, S2+ is bonded in a bent 120 degrees geometry to one N2- and one O2- atom. The S–O bond length is 1.48 Å. O2- is bonded in a single-bond geometry to one S2+ atom. In two of the ONS2 clusters, N2- is bonded in a bent 120 degrees geometry to two S2+ atoms. There is one shorter (1.55 Å) and one longer (1.67 Å) N–S bond length. There are two inequivalent S2+ sites. In the first S2+ site, S2+ is bonded in a single-bond geometry to one N2- atom. In the second S2+ site, S2+ is bonded in a bent 120 degrees geometry to one N2- and one O2- atom. The S–O bond length is 1.48 Å. O2- is bonded in a single-bond geometry to one S2+ atom.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on SN8O13 by Materials Project

(N2)5(NO3)6(SO4)2 crystallizes in the monoclinic P2_1 space group. The structure is zero-dimensional and consists of ten ammonia molecules, six nitric acid molecules, and two sulfuric acid molecules.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on S(NO2)2 by Materials Project

N2SO4 is Iron carbide-derived structured and crystallizes in the orthorhombic Pnma space group. The structure is zero-dimensional and consists of eight ammonia molecules and four sulfuric acid molecules.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on SN4O5 by Materials Project

N2NONSO4 crystallizes in the orthorhombic Pnma space group. The structure is zero-dimensional and consists of eight ammonia molecules, four nitroxyl molecules, and four NSO4 clusters. In each NSO4 cluster, N3+ is bonded in a distorted bent 120 degrees geometry to one S2- and one O2- atom. The N–S bond length is 2.10 Å. The N–O bond length is 1.17 Å. S2- is bonded in a distorted trigonal pyramidal geometry to one N3+ and three O2- atoms. There is one shorter (1.44 Å) and two longer (1.45 Å) S–O bond length. There are three inequivalent O2- sites. In the first O2- site, O2- is bonded in a single-bond geometry to one N3+ atom. In the second O2- site, O2- is bonded in a single-bond geometry to one S2- atom. In the third O2- site, O2- is bonded in a single-bond geometry to one S2- atom.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on S6N5O4 by Materials Project

N2N3S6O4 crystallizes in the monoclinic P2_1/c space group. The structure is one-dimensional and consists of four nitrogen molecules and two N3S6O4 ribbons oriented in the (1, 0, 0) direction. In each N3S6O4 ribbon, there are three inequivalent N+2.40+ sites. In the first N+2.40+ site, N+2.40+ is bonded in a bent 150 degrees geometry to two S+0.67- atoms. There is one shorter (1.50 Å) and one longer (2.03 Å) N–S bond length. In the second N+2.40+ site, N+2.40+ is bonded in a distorted bent 120 degrees geometry to two S+0.67- atoms. There is one shorter (1.59 Å) and one longer (1.67 Å) N–S bond length. In the third N+2.40+ site, N+2.40+ is bonded in a water-like geometry to two S+0.67- atoms. There is one shorter (1.62 Å) and one longer (1.63 Å) N–S bond length. There are six inequivalent S+0.67- sites. In the first S+0.67- site, S+0.67- is bonded in a 4-coordinate geometry to two S+0.67- and two equivalent O2- atoms. There are one shorter (2.05 Å) and one longer (2.14 Å) S–S bond lengths. There are one shorter (3.09 Å) and one longer (3.40 Å) S–O bond lengths. In the second S+0.67- site, S+0.67- is bonded in a 1-coordinate geometry to one N+2.40+ and one S+0.67- atom. In the third S+0.67- site, S+0.67- is bonded in a bent 120 degrees geometry to two N+2.40+ atoms. In the fourth S+0.67- site, S+0.67- is bonded in a 1-coordinate geometry to one N+2.40+, one S+0.67-, and one O2- atom. The S–O bond length is 2.54 Å. In the fifth S+0.67- site, S+0.67- is bonded in a distorted trigonal non-coplanar geometry to one N+2.40+ and two O2- atoms. There is one shorter (1.46 Å) and one longer (1.50 Å) S–O bond length. In the sixth S+0.67- site, S+0.67- is bonded in a trigonal non-coplanar geometry to one N+2.40+ and two O2- atoms. There is one shorter (1.46 Å) and one longer (1.48 Å) S–O bond length. There are four inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted single-bond geometry to three S+0.67- atoms. In the second O2- site, O2- is bonded in a single-bond geometry to one S+0.67- atom. In the third O2- site, O2- is bonded in a distorted single-bond geometry to two S+0.67- atoms. In the fourth O2- site, O2- is bonded in a single-bond geometry to one S+0.67- atom.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on SN2O3 by Materials Project

N2(NSO3)2 is Silicon tetrafluoride-derived structured and crystallizes in the orthorhombic Pbca space group. The structure is zero-dimensional and consists of eight ammonia molecules and eight NSO3 clusters. In each NSO3 cluster, N4+ is bonded in a single-bond geometry to one S2- atom. The N–S bond length is 1.66 Å. S2- is bonded in a tetrahedral geometry to one N4+ and three O2- atoms. There is one shorter (1.46 Å) and two longer (1.47 Å) S–O bond length. There are three inequivalent O2- sites. In the first O2- site, O2- is bonded in a single-bond geometry to one S2- atom. In the second O2- site, O2- is bonded in a single-bond geometry to one S2- atom. In the third O2- site, O2- is bonded in a single-bond geometry to one S2- atom.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on SNO4 by Materials Project

N2(SO4)2 is Silicon tetrafluoride-derived structured and crystallizes in the monoclinic Pc space group. The structure is zero-dimensional and consists of eight ammonia molecules and eight sulfuric acid molecules.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on SNO4 by Materials Project

N2(SO4)2 crystallizes in the monoclinic P2_1/c space group. The structure is zero-dimensional and consists of four ammonia molecules and two peroxydisulfuric acid molecules.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on S(N3O5)2 by Materials Project

(N2)2(NO3)2SO4 crystallizes in the monoclinic P2_1/c space group. The structure is zero-dimensional and consists of sixteen ammonia molecules, eight nitric acid molecules, and four sulfuric acid molecules.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on S2NO9 by Materials Project

NO4SO3SO2 crystallizes in the triclinic P-1 space group. The structure is zero-dimensional and consists of two hydrogen peroxide;nitrous acid molecules, two sulfur dioxide molecules, and two sulfur trioxide molecules.

36 MATERIALS SCIENCE↗