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At least 541 records · Page 30
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DOE OSTI2020

Materials Data on Pu3Pd4 by Materials Project

Pu3Pd4 crystallizes in the trigonal R-3 space group. The structure is three-dimensional. Pu is bonded in a 9-coordinate geometry to nine Pd atoms. There are a spread of Pu–Pd bond distances ranging from 2.90–3.30 Å. There are three inequivalent Pd sites. In the first Pd site, Pd is bonded in a 6-coordinate geometry to six equivalent Pu atoms. In the second Pd site, Pd is bonded in a 6-coordinate geometry to six equivalent Pu atoms. In the third Pd site, Pd is bonded in a 10-coordinate geometry to seven equivalent Pu and three equivalent Pd atoms. There are one shorter (2.87 Å) and two longer (3.02 Å) Pd–Pd bond lengths.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Pu2InPd2 by Materials Project

Pu2Pd2In crystallizes in the tetragonal P4/mbm space group. The structure is three-dimensional. Pu is bonded in a 6-coordinate geometry to six equivalent Pd and four equivalent In atoms. There are two shorter (2.84 Å) and four longer (2.99 Å) Pu–Pd bond lengths. All Pu–In bond lengths are 3.41 Å. Pd is bonded in a 9-coordinate geometry to six equivalent Pu, one Pd, and two equivalent In atoms. The Pd–Pd bond length is 2.88 Å. Both Pd–In bond lengths are 3.01 Å. In is bonded to eight equivalent Pu and four equivalent Pd atoms to form a mixture of face and corner-sharing InPu8Pd4 cuboctahedra.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Pu2SnPt2 by Materials Project

Pu2Pt2Sn crystallizes in the tetragonal P4/mbm space group. The structure is three-dimensional. Pu is bonded in a 6-coordinate geometry to six equivalent Pt and four equivalent Sn atoms. There are two shorter (2.82 Å) and four longer (2.97 Å) Pu–Pt bond lengths. All Pu–Sn bond lengths are 3.39 Å. Pt is bonded in a 6-coordinate geometry to six equivalent Pu, one Pt, and two equivalent Sn atoms. The Pt–Pt bond length is 2.86 Å. Both Pt–Sn bond lengths are 3.01 Å. Sn is bonded to eight equivalent Pu and four equivalent Pt atoms to form a mixture of face and corner-sharing SnPu8Pt4 cuboctahedra.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on PuGa4 by Materials Project

PuGa4 crystallizes in the monoclinic C2/m space group. The structure is three-dimensional. Pu is bonded in a 11-coordinate geometry to thirteen Ga atoms. There are a spread of Pu–Ga bond distances ranging from 2.97–3.13 Å. There are three inequivalent Ga sites. In the first Ga site, Ga is bonded in a 9-coordinate geometry to three equivalent Pu and six Ga atoms. There are a spread of Ga–Ga bond distances ranging from 2.58–2.91 Å. In the second Ga site, Ga is bonded to four equivalent Pu and eight Ga atoms to form a mixture of distorted edge, face, and corner-sharing GaPu4Ga8 cuboctahedra. There are four shorter (3.02 Å) and two longer (3.06 Å) Ga–Ga bond lengths. In the third Ga site, Ga is bonded in a 3-coordinate geometry to three equivalent Pu and eight Ga atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Pu2InRh2 by Materials Project

Pu2Rh2In crystallizes in the tetragonal P4/mbm space group. The structure is three-dimensional. Pu is bonded in a 6-coordinate geometry to six equivalent Rh and four equivalent In atoms. There are two shorter (2.81 Å) and four longer (2.97 Å) Pu–Rh bond lengths. All Pu–In bond lengths are 3.38 Å. Rh is bonded in a 8-coordinate geometry to six equivalent Pu and two equivalent In atoms. Both Rh–In bond lengths are 2.92 Å. In is bonded to eight equivalent Pu and four equivalent Rh atoms to form a mixture of distorted face and corner-sharing InPu8Rh4 cuboctahedra.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Pu2SnPd2 by Materials Project

Pu2Pd2Sn crystallizes in the tetragonal P4/mbm space group. The structure is three-dimensional. Pu is bonded in a 6-coordinate geometry to six equivalent Pd and four equivalent Sn atoms. There are two shorter (2.83 Å) and four longer (3.01 Å) Pu–Pd bond lengths. All Pu–Sn bond lengths are 3.39 Å. Pd is bonded in a 9-coordinate geometry to six equivalent Pu, one Pd, and two equivalent Sn atoms. The Pd–Pd bond length is 2.78 Å. Both Pd–Sn bond lengths are 2.97 Å. Sn is bonded to eight equivalent Pu and four equivalent Pd atoms to form a mixture of face and corner-sharing SnPu8Pd4 cuboctahedra.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Pu2Ni2Sn by Materials Project

Pu2Ni2Sn crystallizes in the tetragonal P4/mbm space group. The structure is three-dimensional. Pu is bonded in a 10-coordinate geometry to six equivalent Ni and four equivalent Sn atoms. There are two shorter (2.82 Å) and four longer (2.90 Å) Pu–Ni bond lengths. All Pu–Sn bond lengths are 3.27 Å. Ni is bonded in a 9-coordinate geometry to six equivalent Pu, one Ni, and two equivalent Sn atoms. The Ni–Ni bond length is 2.48 Å. Both Ni–Sn bond lengths are 2.82 Å. Sn is bonded to eight equivalent Pu and four equivalent Ni atoms to form a mixture of corner and face-sharing SnPu8Ni4 cuboctahedra.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Pu2InNi2 by Materials Project

Pu2Ni2In crystallizes in the tetragonal P4/mbm space group. The structure is three-dimensional. Pu is bonded in a 6-coordinate geometry to six equivalent Ni and four equivalent In atoms. There are two shorter (2.72 Å) and four longer (2.80 Å) Pu–Ni bond lengths. All Pu–In bond lengths are 3.24 Å. Ni is bonded in a 6-coordinate geometry to six equivalent Pu, one Ni, and two equivalent In atoms. The Ni–Ni bond length is 2.75 Å. Both Ni–In bond lengths are 2.86 Å. In is bonded to eight equivalent Pu and four equivalent Ni atoms to form a mixture of distorted corner and face-sharing InPu8Ni4 cuboctahedra.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Pu2InPt2 by Materials Project

Pu2Pt2In crystallizes in the tetragonal P4/mbm space group. The structure is three-dimensional. Pu is bonded in a 6-coordinate geometry to six equivalent Pt and four equivalent In atoms. There are two shorter (2.91 Å) and four longer (3.05 Å) Pu–Pt bond lengths. All Pu–In bond lengths are 3.49 Å. Pt is bonded in a 9-coordinate geometry to six equivalent Pu and two equivalent In atoms. Both Pt–In bond lengths are 3.09 Å. In is bonded to eight equivalent Pu and four equivalent Pt atoms to form a mixture of face and corner-sharing InPu8Pt4 cuboctahedra.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on PuBiPd2 by Materials Project

PuPd2Bi is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Pu is bonded in a body-centered cubic geometry to eight equivalent Pd and six equivalent Bi atoms. All Pu–Pd bond lengths are 3.00 Å. All Pu–Bi bond lengths are 3.46 Å. Pd is bonded in a body-centered cubic geometry to four equivalent Pu and four equivalent Bi atoms. All Pd–Bi bond lengths are 3.00 Å. Bi is bonded in a distorted body-centered cubic geometry to six equivalent Pu and eight equivalent Pd atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on PuSbPd2 by Materials Project

PuPd2Sb is Heusler structured and crystallizes in the orthorhombic Immm space group. The structure is three-dimensional. Pu is bonded in a distorted body-centered cubic geometry to eight equivalent Pd and six equivalent Sb atoms. There are four shorter (2.95 Å) and four longer (2.96 Å) Pu–Pd bond lengths. There are four shorter (3.41 Å) and two longer (3.42 Å) Pu–Sb bond lengths. Pd is bonded in a body-centered cubic geometry to four equivalent Pu and four equivalent Sb atoms. There are two shorter (2.95 Å) and two longer (2.96 Å) Pd–Sb bond lengths. Sb is bonded in a 8-coordinate geometry to six equivalent Pu and eight equivalent Pd atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Pu2HgBi by Materials Project

Pu2HgBi is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Pu is bonded in a body-centered cubic geometry to four equivalent Hg and four equivalent Bi atoms. All Pu–Hg bond lengths are 3.32 Å. All Pu–Bi bond lengths are 3.32 Å. Hg is bonded in a body-centered cubic geometry to eight equivalent Pu atoms. Bi is bonded in a body-centered cubic geometry to eight equivalent Pu atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Pu2BiAu by Materials Project

Pu2AuBi is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Pu is bonded in a body-centered cubic geometry to four equivalent Au and four equivalent Bi atoms. All Pu–Au bond lengths are 3.28 Å. All Pu–Bi bond lengths are 3.28 Å. Au is bonded in a body-centered cubic geometry to eight equivalent Pu atoms. Bi is bonded in a body-centered cubic geometry to eight equivalent Pu atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Pu2HgSb by Materials Project

Pu2HgSb is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Pu is bonded in a body-centered cubic geometry to four equivalent Hg and four equivalent Sb atoms. All Pu–Hg bond lengths are 3.27 Å. All Pu–Sb bond lengths are 3.27 Å. Hg is bonded in a body-centered cubic geometry to eight equivalent Pu atoms. Sb is bonded in a body-centered cubic geometry to eight equivalent Pu atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Li3Pu by Materials Project

Li3Pu is alpha bismuth trifluoride structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. there are two inequivalent Li sites. In the first Li site, Li is bonded in a body-centered cubic geometry to four equivalent Li and four equivalent Pu atoms. All Li–Li bond lengths are 3.11 Å. All Li–Pu bond lengths are 3.11 Å. In the second Li site, Li is bonded in a 8-coordinate geometry to eight equivalent Li and six equivalent Pu atoms. All Li–Pu bond lengths are 3.59 Å. Pu is bonded in a distorted body-centered cubic geometry to fourteen Li atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Na3Pu by Materials Project

Na3Pu is alpha bismuth trifluoride structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. there are two inequivalent Na sites. In the first Na site, Na is bonded in a distorted body-centered cubic geometry to four equivalent Na and four equivalent Pu atoms. All Na–Na bond lengths are 3.63 Å. All Na–Pu bond lengths are 3.63 Å. In the second Na site, Na is bonded in a 8-coordinate geometry to eight equivalent Na and six equivalent Pu atoms. All Na–Pu bond lengths are 4.19 Å. Pu is bonded in a body-centered cubic geometry to fourteen Na atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on PuMg3 by Materials Project

Mg3Pu is alpha bismuth trifluoride structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. there are two inequivalent Mg sites. In the first Mg site, Mg is bonded in a body-centered cubic geometry to four equivalent Mg and four equivalent Pu atoms. All Mg–Mg bond lengths are 3.12 Å. All Mg–Pu bond lengths are 3.12 Å. In the second Mg site, Mg is bonded in a distorted body-centered cubic geometry to eight equivalent Mg and six equivalent Pu atoms. All Mg–Pu bond lengths are 3.60 Å. Pu is bonded in a distorted body-centered cubic geometry to fourteen Mg atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on PuInHg2 by Materials Project

PuHg2In is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Pu is bonded in a body-centered cubic geometry to eight equivalent Hg and six equivalent In atoms. All Pu–Hg bond lengths are 3.19 Å. All Pu–In bond lengths are 3.69 Å. Hg is bonded in a body-centered cubic geometry to four equivalent Pu and four equivalent In atoms. All Hg–In bond lengths are 3.19 Å. In is bonded in a distorted body-centered cubic geometry to six equivalent Pu and eight equivalent Hg atoms.

36 MATERIALS SCIENCE↗