Engineering Papers⌕ Search

SEARCH · Engineering Papers

Results for “NO3”

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.

Quote a phrase for an exact phrase match. Source license links do not imply unrestricted reuse.

At least 325 records · Page 18
All sourcesNASA NTRSDOE OSTI
DOE OSTI2024

Comparing the Recovery of Arbuscular and Ectomycorrhizal Stands from Long-Term Nitrogen Fertilization at the Fernow Experimental Forest, WV (2021 and 2022)

This data was generated to answer the research question: After the end of a 30-year nitrogen (N) fertilization experiment in an Eastern temperate forest, to what extent do plant microbial interactions and carbon cycling in arbuscular mycorrhizal (AM) and ectomycorrhizal (ECM) dominated stands follow different recovery trajectories?The soil and the roots used in this dataset were sampled from two watersheds (N-fertilized watershed 3 and Reference watershed 7) with 6 AM and 6 ECM dominated stands each, over the course of three months (June, July, August) in 2021 and 2022. The "All_Roots.csv" data includes fine root biomass (in g) scaled to sampled soil (m2) (Scaled_Rt_Bm_gm2), and AM and ECM root colonization (%) in two soil fractions: the organic horizon (O) and the mineral horizon (B). The "All_Enzymes.csv" data includes extracellular soil enzyme activity (N-acetyl-glucosaminidase (NAG), acid phosphatase (AP), β-glucosidase (BG), phenol oxidase and peroxidase), and the ratios of BG to AP (BG:AP) and BG to NAG (BG:NAG) in three soil fractions: the organic horizon (O), the bulk soil (B), and the rhizosphere (R).The "All_Nmin" data includes inorganic N (NO3- and NH4+) pools (unit: μg of N per g of dry soil) measured pre- (I_Nitrate_ugNgsoil and I_Ammonia_ugNgsoil) and post-incubation (F_Nitrate_ugNgsoil and F_Ammonia_ugNgsoil), as well as calculated nitrification (Nitrification_day) and nitrogen mineralization (Mineralization_day) rates per day, in three soil fractions: the organic horizon (O), the bulk soil (B), and the rhizosphere (R).

54 ENVIRONMENTAL SCIENCES↗
DOE OSTI2020

Materials Data on UH12C4N4O11 by Materials Project

UNO5N(CH3)4(NO3)2 crystallizes in the monoclinic P2_1/c space group. The structure is zero-dimensional and consists of eight nitric acid molecules, four tetramethylammonium molecules, and four UNO5 clusters. In each UNO5 cluster, U6+ is bonded in a distorted linear geometry to four O2- atoms. There are a spread of U–O bond distances ranging from 1.80–2.49 Å. N3- is bonded in a trigonal planar geometry to three O2- atoms. There are a spread of N–O bond distances ranging from 1.22–1.30 Å. There are five inequivalent O2- sites. In the first O2- site, O2- is bonded in a single-bond geometry to one U6+ atom. In the second O2- site, O2- is bonded in a distorted single-bond geometry to one U6+ and one N3- atom. In the third O2- site, O2- is bonded in a distorted L-shaped geometry to one U6+ and one N3- atom. In the fourth O2- site, O2- is bonded in a single-bond geometry to one U6+ atom. In the fifth O2- site, O2- is bonded in a single-bond geometry to one N3- atom.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on AuN5O14 by Materials Project

Au(NO3)4NO2 crystallizes in the monoclinic P2_1/c space group. The structure is zero-dimensional and consists of two chebi:30328 molecules and two hydroxylamine, n-hydroxy- molecules.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Mn4Bi3NO15 by Materials Project

Bi3Mn4O12(NO3) is beta Vanadium nitride-derived structured and crystallizes in the trigonal P3 space group. The structure is two-dimensional and consists of one nitric acid molecule and one Mn4(BiO4)3 sheet oriented in the (0, 0, 1) direction. In the Mn4(BiO4)3 sheet, there are four inequivalent Mn6+ sites. In the first Mn6+ site, Mn6+ is bonded to six O2- atoms to form MnO6 octahedra that share corners with three equivalent BiO6 octahedra and edges with three equivalent MnO6 octahedra. The corner-sharing octahedral tilt angles are 53°. There is three shorter (1.90 Å) and three longer (1.96 Å) Mn–O bond length. In the second Mn6+ site, Mn6+ is bonded to six O2- atoms to form MnO6 octahedra that share corners with three equivalent BiO6 octahedra and edges with three equivalent MnO6 octahedra. The corner-sharing octahedral tilt angles are 54°. There is three shorter (1.89 Å) and three longer (1.96 Å) Mn–O bond length. In the third Mn6+ site, Mn6+ is bonded to six O2- atoms to form MnO6 octahedra that share corners with three equivalent BiO6 octahedra and edges with three equivalent MnO6 octahedra. The corner-sharing octahedral tilt angles are 54°. There is three shorter (1.90 Å) and three longer (1.96 Å) Mn–O bond length. In the fourth Mn6+ site, Mn6+ is bonded to six O2- atoms to form MnO6 octahedra that share corners with three equivalent BiO6 octahedra and edges with three equivalent MnO6 octahedra. The corner-sharing octahedral tilt angles are 54°. There is three shorter (1.90 Å) and three longer (1.96 Å) Mn–O bond length. There are three inequivalent Bi3+ sites. In the first Bi3+ site, Bi3+ is bonded to six O2- atoms to form BiO6 octahedra that share corners with twelve MnO6 octahedra. The corner-sharing octahedra tilt angles range from 53–54°. There are three shorter (2.37 Å) and three longer (2.38 Å) Bi–O bond lengths. In the second Bi3+ site, Bi3+ is bonded in a distorted T-shaped geometry to three equivalent O2- atoms. All Bi–O bond lengths are 2.16 Å. In the third Bi3+ site, Bi3+ is bonded in a 3-coordinate geometry to three equivalent O2- atoms. All Bi–O bond lengths are 2.16 Å. There are four inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted trigonal planar geometry to two Mn6+ and one Bi3+ atom. In the second O2- site, O2- is bonded in a distorted trigonal planar geometry to two Mn6+ and one Bi3+ atom. In the third O2- site, O2- is bonded in a distorted trigonal planar geometry to two Mn6+ and one Bi3+ atom. In the fourth O2- site, O2- is bonded in a distorted trigonal planar geometry to two Mn6+ and one Bi3+ atom.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on NiH48C16S8(NO7)2 by Materials Project

Ni(SO)6(CH3)16(NO3)2(SO)2 crystallizes in the triclinic P-1 space group. The structure is zero-dimensional and consists of sixteen methane molecules, two nitric acid molecules, two sulfur monoxide molecules, and one Ni(SO)6 cluster. In the Ni(SO)6 cluster, Ni is bonded in an octahedral geometry to six O atoms. There are a spread of Ni–O bond distances ranging from 2.08–2.10 Å. There are three inequivalent S sites. In the first S site, S is bonded in a distorted single-bond geometry to one O atom. The S–O bond length is 1.53 Å. In the second S site, S is bonded in a distorted single-bond geometry to one O atom. The S–O bond length is 1.54 Å. In the third S site, S is bonded in a distorted single-bond geometry to one O atom. The S–O bond length is 1.53 Å. There are three inequivalent O sites. In the first O site, O is bonded in a bent 120 degrees geometry to one Ni and one S atom. In the second O site, O is bonded in a bent 120 degrees geometry to one Ni and one S atom. In the third O site, O is bonded in a bent 120 degrees geometry to one Ni and one S atom.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on H8(NO2)3 by Materials Project

(NH4)4(NO3)2(O2)3 crystallizes in the triclinic P1 space group. The structure is zero-dimensional and consists of two ammonium molecules, one peroxynitrous acid molecule, and one trioxidane molecule.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Yb6H20N8O49 by Materials Project

Yb6N6H20O43(NO3)2 crystallizes in the triclinic P-1 space group. The structure is one-dimensional and consists of two nitric acid molecules and one Yb6N6H20O43 ribbon oriented in the (0, 1, 0) direction. In the Yb6N6H20O43 ribbon, there are three inequivalent Yb sites. In the first Yb site, Yb is bonded in a 9-coordinate geometry to nine O atoms. There are a spread of Yb–O bond distances ranging from 2.38–2.61 Å. In the second Yb site, Yb is bonded in a 9-coordinate geometry to nine O atoms. There are a spread of Yb–O bond distances ranging from 2.29–2.75 Å. In the third Yb site, Yb is bonded in a 8-coordinate geometry to eight O atoms. There are a spread of Yb–O bond distances ranging from 2.32–2.53 Å. There are three inequivalent N sites. In the first N site, N is bonded in a trigonal planar geometry to three O atoms. There is one shorter (1.26 Å) and two longer (1.27 Å) N–O bond length. In the second N site, N is bonded in a trigonal planar geometry to three O atoms. There are a spread of N–O bond distances ranging from 1.25–1.27 Å. In the third N site, N is bonded in a trigonal planar geometry to three O atoms. There are a spread of N–O bond distances ranging from 1.25–1.29 Å. There are ten inequivalent H sites. In the first H site, H is bonded in a single-bond geometry to one O atom. The H–O bond length is 0.98 Å. In the second H site, H is bonded in a single-bond geometry to one O atom. The H–O bond length is 0.98 Å. In the third H site, H is bonded in a distorted linear geometry to two O atoms. There is one shorter (1.02 Å) and one longer (1.63 Å) H–O bond length. In the fourth H site, H is bonded in a single-bond geometry to one O atom. The H–O bond length is 0.98 Å. In the fifth H site, H is bonded in a single-bond geometry to one O atom. The H–O bond length is 0.98 Å. In the sixth H site, H is bonded in a single-bond geometry to one O atom. The H–O bond length is 0.99 Å. In the seventh H site, H is bonded in a single-bond geometry to one O atom. The H–O bond length is 0.99 Å. In the eighth H site, H is bonded in a single-bond geometry to one O atom. The H–O bond length is 0.98 Å. In the ninth H site, H is bonded in a distorted single-bond geometry to two O atoms. There is one shorter (1.01 Å) and one longer (1.70 Å) H–O bond length. In the tenth H site, H is bonded in a single-bond geometry to one O atom. The H–O bond length is 0.99 Å. There are twenty-two inequivalent O sites. In the first O site, O is bonded in an octahedral geometry to six Yb atoms. In the second O site, O is bonded in a distorted single-bond geometry to three Yb and one H atom. In the third O site, O is bonded in a distorted single-bond geometry to three Yb and one H atom. In the fourth O site, O is bonded in a distorted single-bond geometry to three Yb and one H atom. In the fifth O site, O is bonded in a distorted single-bond geometry to three Yb and one H atom. In the sixth O site, O is bonded in a water-like geometry to one Yb and two H atoms. In the seventh O site, O is bonded in a distorted single-bond geometry to one Yb and one H atom. In the eighth O site, O is bonded in a single-bond geometry to one Yb and one H atom. In the ninth O site, O is bonded in a single-bond geometry to one Yb and one H atom. In the tenth O site, O is bonded in a bent 120 degrees geometry to two O atoms. There is one shorter (1.27 Å) and one longer (1.31 Å) O–O bond length. In the eleventh O site, O is bonded in a water-like geometry to one Yb and one O atom. In the twelfth O site, O is bonded in a single-bond geometry to one O atom. In the thirteenth O site, O is bonded in a distorted single-bond geometry to two H atoms. In the fourteenth O site, O is bonded in a distorted single-bond geometry to one Yb and one N atom. In the fifteenth O site, O is bonded in a distorted L-shaped geometry to one Yb and one N atom. In the sixteenth O site, O is bonded in a distorted bent 120 degrees geometry to one N and one H atom. In the seventeenth O site, O is bonded in a single-bond geometry to one Yb and one N atom. In the eighteenth O site, O is bonded in a distorted water-like geometry to one Yb and one N atom. In the nineteenth O site, O is bonded in a single-bond geometry to one N atom. In the twentieth O site, O is bonded in a distorted L-shaped geometry to one Yb and one N atom. In the twenty-first O site, O is bonded in a distorted L-shaped geometry to one Yb and one N atom. In the twenty-second O site, O is bonded in a single-bond geometry to one N atom.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on ZnH16C4S4(N5O3)2 by Materials Project

ZnC4H12(N2S)4(H2)2(NO3)2 crystallizes in the orthorhombic Pccn space group. The structure is zero-dimensional and consists of eight dihydrogen molecules, eight nitric acid molecules, and four ZnC4H12(N2S)4 clusters. In each ZnC4H12(N2S)4 cluster, Zn2+ is bonded in a distorted tetrahedral geometry to four S2- atoms. There are two shorter (2.37 Å) and two longer (2.38 Å) Zn–S bond lengths. There are two inequivalent C4+ sites. In the first C4+ site, C4+ is bonded in a distorted single-bond geometry to one N+1.40- and one S2- atom. The C–N bond length is 1.28 Å. The C–S bond length is 1.63 Å. In the second C4+ site, C4+ is bonded in a trigonal planar geometry to three N+1.40- atoms. There is two shorter (1.34 Å) and one longer (1.36 Å) C–N bond length. There are four inequivalent N+1.40- sites. In the first N+1.40- site, N+1.40- is bonded in a trigonal planar geometry to one C4+ and two equivalent H1+ atoms. Both N–H bond lengths are 1.02 Å. In the second N+1.40- site, N+1.40- is bonded in a trigonal planar geometry to one C4+ and two H1+ atoms. Both N–H bond lengths are 1.02 Å. In the third N+1.40- site, N+1.40- is bonded in a trigonal planar geometry to one C4+ and two H1+ atoms. There is one shorter (1.04 Å) and one longer (1.05 Å) N–H bond length. In the fourth N+1.40- site, N+1.40- is bonded in a bent 120 degrees geometry to one C4+ and one S2- atom. The N–S bond length is 1.62 Å. There are five inequivalent H1+ sites. In the first H1+ site, H1+ is bonded in a single-bond geometry to one N+1.40- atom. In the second H1+ site, H1+ is bonded in a single-bond geometry to one N+1.40- atom. In the third H1+ site, H1+ is bonded in a single-bond geometry to one N+1.40- atom. In the fourth H1+ site, H1+ is bonded in a single-bond geometry to one N+1.40- atom. In the fifth H1+ site, H1+ is bonded in a single-bond geometry to one N+1.40- atom. There are two inequivalent S2- sites. In the first S2- site, S2- is bonded in a distorted water-like geometry to one Zn2+ and one N+1.40- atom. In the second S2- site, S2- is bonded in an L-shaped geometry to one Zn2+ and one C4+ atom.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on H12PtN6(ClO3)2 by Materials Project

Pt(NH3)4Cl2(NO3)2 crystallizes in the triclinic P-1 space group. The structure is zero-dimensional and consists of two nitric acid molecules and one Pt(NH3)4Cl2 cluster. In the Pt(NH3)4Cl2 cluster, Pt4+ is bonded in an octahedral geometry to four N+0.33- and two equivalent Cl1- atoms. There are two shorter (2.07 Å) and two longer (2.08 Å) Pt–N bond lengths. Both Pt–Cl bond lengths are 2.34 Å. There are two inequivalent N+0.33- sites. In the first N+0.33- site, N+0.33- is bonded in a distorted trigonal non-coplanar geometry to one Pt4+ and three H1+ atoms. There is one shorter (1.03 Å) and two longer (1.04 Å) N–H bond length. In the second N+0.33- site, N+0.33- is bonded in a distorted trigonal non-coplanar geometry to one Pt4+ and three H1+ atoms. There is two shorter (1.03 Å) and one longer (1.04 Å) N–H bond length. There are six inequivalent H1+ sites. In the first H1+ site, H1+ is bonded in a single-bond geometry to one N+0.33- atom. In the second H1+ site, H1+ is bonded in a single-bond geometry to one N+0.33- atom. In the third H1+ site, H1+ is bonded in a single-bond geometry to one N+0.33- atom. In the fourth H1+ site, H1+ is bonded in a single-bond geometry to one N+0.33- atom. In the fifth H1+ site, H1+ is bonded in a single-bond geometry to one N+0.33- atom. In the sixth H1+ site, H1+ is bonded in a single-bond geometry to one N+0.33- atom. Cl1- is bonded in a single-bond geometry to one Pt4+ atom.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on MgH12(NO6)2 by Materials Project

Mg(H2O)6(NO3)2 crystallizes in the monoclinic P2_1/c space group. The structure is zero-dimensional and consists of two magnesium;hexahydrate molecules and four nitric acid molecules.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on H9C2N7O6 by Materials Project

C2N5H9(NO3)2 crystallizes in the orthorhombic Pca2_1 space group. The structure is zero-dimensional and consists of four ac1nqwip molecules and eight nitric acid molecules.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on CoH17C(NO)8 by Materials Project

CoCH17(N3O)2(NO3)2 crystallizes in the monoclinic Cc space group. The structure is zero-dimensional and consists of eight nitric acid molecules and four CoCH17(N3O)2 clusters. In each CoCH17(N3O)2 cluster, Co3+ is bonded in an octahedral geometry to five N1- and one O2- atom. There are a spread of Co–N bond distances ranging from 2.11–2.15 Å. The Co–O bond length is 1.93 Å. C4+ is bonded in a trigonal planar geometry to one N1- and two O2- atoms. The C–N bond length is 1.37 Å. There is one shorter (1.26 Å) and one longer (1.32 Å) C–O bond length. There are six inequivalent N1- sites. In the first N1- site, N1- is bonded in a distorted trigonal non-coplanar geometry to one Co3+ and three H1+ atoms. There is one shorter (1.02 Å) and two longer (1.03 Å) N–H bond length. In the second N1- site, N1- is bonded in a distorted trigonal non-coplanar geometry to one Co3+ and three H1+ atoms. All N–H bond lengths are 1.03 Å. In the third N1- site, N1- is bonded in a distorted trigonal non-coplanar geometry to one Co3+ and three H1+ atoms. There is one shorter (1.02 Å) and two longer (1.03 Å) N–H bond length. In the fourth N1- site, N1- is bonded in a distorted trigonal non-coplanar geometry to one Co3+ and three H1+ atoms. There is one shorter (1.02 Å) and two longer (1.03 Å) N–H bond length. In the fifth N1- site, N1- is bonded in a distorted trigonal non-coplanar geometry to one Co3+ and three H1+ atoms. All N–H bond lengths are 1.03 Å. In the sixth N1- site, N1- is bonded in a distorted trigonal planar geometry to one C4+ and two H1+ atoms. There is one shorter (1.01 Å) and one longer (1.02 Å) N–H bond length. There are seventeen inequivalent H1+ sites. In the first H1+ site, H1+ is bonded in a single-bond geometry to one N1- atom. In the second H1+ site, H1+ is bonded in a single-bond geometry to one N1- atom. In the third H1+ site, H1+ is bonded in a single-bond geometry to one N1- atom. In the fourth H1+ site, H1+ is bonded in a single-bond geometry to one N1- atom. In the fifth H1+ site, H1+ is bonded in a single-bond geometry to one N1- atom. In the sixth H1+ site, H1+ is bonded in a single-bond geometry to one N1- atom. In the seventh H1+ site, H1+ is bonded in a single-bond geometry to one N1- atom. In the eighth H1+ site, H1+ is bonded in a single-bond geometry to one N1- atom. In the ninth H1+ site, H1+ is bonded in a single-bond geometry to one N1- atom. In the tenth H1+ site, H1+ is bonded in a single-bond geometry to one N1- atom. In the eleventh H1+ site, H1+ is bonded in a single-bond geometry to one N1- atom. In the twelfth H1+ site, H1+ is bonded in a single-bond geometry to one N1- atom. In the thirteenth H1+ site, H1+ is bonded in a single-bond geometry to one N1- atom. In the fourteenth H1+ site, H1+ is bonded in a single-bond geometry to one N1- atom. In the fifteenth H1+ site, H1+ is bonded in a single-bond geometry to one N1- atom. In the sixteenth H1+ site, H1+ is bonded in a single-bond geometry to one N1- atom. In the seventeenth H1+ site, H1+ is bonded in a single-bond geometry to one N1- atom. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted bent 120 degrees geometry to one Co3+ and one C4+ atom. In the second O2- site, O2- is bonded in a single-bond geometry to one C4+ atom.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on MnH30C8(N13O9)2 by Materials Project

MnH21(C2N5)3C2N5H9(NO3)6 crystallizes in the triclinic P-1 space group. The structure is zero-dimensional and consists of two ac1nqwip molecules, twelve nitric acid molecules, and two MnH21(C2N5)3 clusters. In each MnH21(C2N5)3 cluster, Mn is bonded in an octahedral geometry to six N atoms. There are a spread of Mn–N bond distances ranging from 1.94–1.98 Å. There are six inequivalent C sites. In the first C site, C is bonded in a trigonal planar geometry to three N atoms. There are a spread of C–N bond distances ranging from 1.32–1.37 Å. In the second C site, C is bonded in a trigonal planar geometry to three N atoms. There are a spread of C–N bond distances ranging from 1.32–1.37 Å. In the third C site, C is bonded in a trigonal planar geometry to three N atoms. There are a spread of C–N bond distances ranging from 1.31–1.38 Å. In the fourth C site, C is bonded in a trigonal planar geometry to three N atoms. There are a spread of C–N bond distances ranging from 1.31–1.38 Å. In the fifth C site, C is bonded in a trigonal planar geometry to three N atoms. There are a spread of C–N bond distances ranging from 1.31–1.37 Å. In the sixth C site, C is bonded in a trigonal planar geometry to three N atoms. There are a spread of C–N bond distances ranging from 1.32–1.38 Å. There are fifteen inequivalent N sites. In the first N site, N is bonded in a distorted trigonal planar geometry to one Mn, one C, and one H atom. The N–H bond length is 1.03 Å. In the second N site, N is bonded in a trigonal planar geometry to one C and two H atoms. Both N–H bond lengths are 1.02 Å. In the third N site, N is bonded in a trigonal planar geometry to two C and one H atom. The N–H bond length is 1.04 Å. In the fourth N site, N is bonded in a distorted trigonal planar geometry to one Mn, one C, and one H atom. The N–H bond length is 1.03 Å. In the fifth N site, N is bonded in a trigonal planar geometry to one C and two H atoms. Both N–H bond lengths are 1.03 Å. In the sixth N site, N is bonded in a distorted trigonal planar geometry to one Mn, one C, and one H atom. The N–H bond length is 1.02 Å. In the seventh N site, N is bonded in a trigonal planar geometry to one C and two H atoms. Both N–H bond lengths are 1.02 Å. In the eighth N site, N is bonded in a trigonal planar geometry to two C and one H atom. The N–H bond length is 1.04 Å. In the ninth N site, N is bonded in a distorted trigonal planar geometry to one Mn, one C, and one H atom. The N–H bond length is 1.03 Å. In the tenth N site, N is bonded in a trigonal planar geometry to one C and two H atoms. Both N–H bond lengths are 1.02 Å. In the eleventh N site, N is bonded in a trigonal planar geometry to one Mn, one C, and one H atom. The N–H bond length is 1.03 Å. In the twelfth N site, N is bonded in a trigonal planar geometry to one C and two H atoms. There is one shorter (1.02 Å) and one longer (1.03 Å) N–H bond length. In the thirteenth N site, N is bonded in a trigonal planar geometry to two C and one H atom. The N–H bond length is 1.03 Å. In the fourteenth N site, N is bonded in a distorted trigonal planar geometry to one Mn, one C, and one H atom. The N–H bond length is 1.03 Å. In the fifteenth N site, N is bonded in a trigonal planar geometry to one C and two H atoms. Both N–H bond lengths are 1.02 Å. There are twenty-one inequivalent H sites. In the first H site, H is bonded in a single-bond geometry to one N atom. In the second H site, H is bonded in a single-bond geometry to one N atom. In the third H site, H is bonded in a single-bond geometry to one N atom. In the fourth H site, H is bonded in a single-bond geometry to one N atom. In the fifth H site, H is bonded in a single-bond geometry to one N atom. In the sixth H site, H is bonded in a single-bond geometry to one N atom. In the seventh H site, H is bonded in a single-bond geometry to one N atom. In the eighth H site, H is bonded in a single-bond geometry to one N atom. In the ninth H site, H is bonded in a single-bond geometry to one N atom. In the tenth H site, H is bonded in a single-bond geometry to one N atom. In the eleventh H site, H is bonded in a single-bond geometry to one N atom. In the twelfth H site, H is bonded in a single-bond geometry to one N atom. In the thirteenth H site, H is bonded in a single-bond geometry to one N atom. In the fourteenth H site, H is bonded in a single-bond geometry to one N atom. In the fifteenth H site, H is bonded in a single-bond geometry to one N atom. In the sixteenth H site, H is bonded in a single-bond geometry to one N atom. In the seventeenth H site, H is bonded in a single-bond geometry to one N atom. In the eighteenth H site, H is bonded in a single-bond geometry to one N atom. In the nineteenth H site, H is bonded in a single-bond geometry to one N atom. In the twentieth H site, H is bonded in a single-bond geometry to one N atom. In the twenty-first H site, H is bonded in a single-bond geometry to one N atom.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on NiH44C12(N5O8)2 by Materials Project

Ni(H2O)6(C3N2H6)4(NO3)2(H2O)4 crystallizes in the triclinic P-1 space group. The structure is zero-dimensional and consists of two methenamine molecules, two nitric acid molecules, one nsvfpfuroxfzjs-uhfffaoysa-n molecule, and four water molecules.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on UH12(NO7)2 by Materials Project

UO2(NO3)2(H2O)6 crystallizes in the orthorhombic Cmc2_1 space group. The structure is zero-dimensional and consists of eight nitric acid molecules; four pitchblend, uranium(iv) oxide, uranium(iv) dioxide, uranium dioxide molecules; and twenty-four water molecules.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on SbN3(O3F)3 by Materials Project

(NO3)3SbF3 crystallizes in the orthorhombic Cmc2_1 space group. The structure is zero-dimensional and consists of four antimony trifluoride molecules and twelve nitric acid molecules.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Pb13(N2O13)2 by Materials Project

Pb13O14(NO3)4 crystallizes in the triclinic P-1 space group. The structure is zero-dimensional and consists of four nitric acid molecules and one Pb13O14 cluster. In the Pb13O14 cluster, there are seven inequivalent Pb+2.46+ sites. In the first Pb+2.46+ site, Pb+2.46+ is bonded in a 3-coordinate geometry to three O2- atoms. There are a spread of Pb–O bond distances ranging from 2.25–2.40 Å. In the second Pb+2.46+ site, Pb+2.46+ is bonded in a 3-coordinate geometry to three O2- atoms. There are a spread of Pb–O bond distances ranging from 2.25–2.40 Å. In the third Pb+2.46+ site, Pb+2.46+ is bonded in a 3-coordinate geometry to three O2- atoms. There are a spread of Pb–O bond distances ranging from 2.25–2.40 Å. In the fourth Pb+2.46+ site, Pb+2.46+ is bonded in a body-centered cubic geometry to eight O2- atoms. There are a spread of Pb–O bond distances ranging from 2.38–2.47 Å. In the fifth Pb+2.46+ site, Pb+2.46+ is bonded in a 3-coordinate geometry to three O2- atoms. There are a spread of Pb–O bond distances ranging from 2.19–2.30 Å. In the sixth Pb+2.46+ site, Pb+2.46+ is bonded in a 3-coordinate geometry to three O2- atoms. There are a spread of Pb–O bond distances ranging from 2.19–2.30 Å. In the seventh Pb+2.46+ site, Pb+2.46+ is bonded in a 3-coordinate geometry to three O2- atoms. There are a spread of Pb–O bond distances ranging from 2.18–2.30 Å. There are seven inequivalent O2- sites. In the first O2- site, O2- is bonded in a 2-coordinate geometry to two Pb+2.46+ atoms. In the second O2- site, O2- is bonded in a 2-coordinate geometry to two Pb+2.46+ atoms. In the third O2- site, O2- is bonded to four Pb+2.46+ atoms to form a mixture of corner and edge-sharing OPb4 tetrahedra. In the fourth O2- site, O2- is bonded to four Pb+2.46+ atoms to form a mixture of corner and edge-sharing OPb4 tetrahedra. In the fifth O2- site, O2- is bonded to four Pb+2.46+ atoms to form a mixture of corner and edge-sharing OPb4 tetrahedra. In the sixth O2- site, O2- is bonded to four Pb+2.46+ atoms to form a mixture of corner and edge-sharing OPb4 tetrahedra. In the seventh O2- site, O2- is bonded in a 2-coordinate geometry to two Pb+2.46+ atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Co2N16O9 by Materials Project

Co2N5(N2)4(NO3)3 crystallizes in the tetragonal P4_2nm space group. The structure is zero-dimensional and consists of four ammonia molecules, six nitric acid molecules, four triazane molecules, and two Co2N5 clusters. In each Co2N5 cluster, Co2+ is bonded in a trigonal planar geometry to three N+0.88+ atoms. There is two shorter (1.59 Å) and one longer (1.67 Å) Co–N bond length. There are two inequivalent N+0.88+ sites. In the first N+0.88+ site, N+0.88+ is bonded in a bent 150 degrees geometry to two equivalent Co2+ atoms. In the second N+0.88+ site, N+0.88+ is bonded in a single-bond geometry to one Co2+ atom.

36 MATERIALS SCIENCE↗