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DOE OSTI2020

Materials Data on EuAgGe by Materials Project

EuAgGe crystallizes in the monoclinic C2/m space group. The structure is three-dimensional. Eu is bonded in a 12-coordinate geometry to six equivalent Ag and six equivalent Ge atoms. There are a spread of Eu–Ag bond distances ranging from 3.21–3.46 Å. There are a spread of Eu–Ge bond distances ranging from 3.22–3.40 Å. Ag is bonded in a 10-coordinate geometry to six equivalent Eu, one Ag, and three equivalent Ge atoms. The Ag–Ag bond length is 2.87 Å. There are two shorter (2.70 Å) and one longer (3.05 Å) Ag–Ge bond lengths. Ge is bonded in a 10-coordinate geometry to six equivalent Eu, three equivalent Ag, and one Ge atom. The Ge–Ge bond length is 2.53 Å.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Li2EuIn by Materials Project

Li2EuIn is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Li is bonded in a body-centered cubic geometry to four equivalent Eu and four equivalent In atoms. All Li–Eu bond lengths are 3.10 Å. All Li–In bond lengths are 3.10 Å. Eu is bonded in a distorted body-centered cubic geometry to eight equivalent Li and six equivalent In atoms. All Eu–In bond lengths are 3.58 Å. In is bonded in a body-centered cubic geometry to eight equivalent Li and six equivalent Eu atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on EuGe7Ir3 by Materials Project

EuIr3Ge7 crystallizes in the trigonal R-3c space group. The structure is three-dimensional. Eu is bonded in a 12-coordinate geometry to six equivalent Ir and twelve equivalent Ge atoms. All Eu–Ir bond lengths are 3.24 Å. There are six shorter (3.29 Å) and six longer (3.30 Å) Eu–Ge bond lengths. Ir is bonded in a 9-coordinate geometry to two equivalent Eu and seven Ge atoms. There are a spread of Ir–Ge bond distances ranging from 2.53–2.65 Å. There are two inequivalent Ge sites. In the first Ge site, Ge is bonded in a trigonal planar geometry to three equivalent Ir and six equivalent Ge atoms. All Ge–Ge bond lengths are 2.89 Å. In the second Ge site, Ge is bonded in a 3-coordinate geometry to two equivalent Eu, three equivalent Ir, and five Ge atoms. There are a spread of Ge–Ge bond distances ranging from 2.79–2.91 Å.

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DOE OSTI2020

Materials Data on EuZnAu by Materials Project

EuAuZn crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Eu is bonded in a 12-coordinate geometry to six equivalent Au and six equivalent Zn atoms. There are a spread of Eu–Au bond distances ranging from 3.21–3.54 Å. There are a spread of Eu–Zn bond distances ranging from 3.24–3.49 Å. Au is bonded in a 10-coordinate geometry to six equivalent Eu and four equivalent Zn atoms. There are a spread of Au–Zn bond distances ranging from 2.74–2.87 Å. Zn is bonded in a 4-coordinate geometry to six equivalent Eu and four equivalent Au atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Eu2MnP3Pt7 by Materials Project

Eu2MnPt7P3 crystallizes in the tetragonal I-4m2 space group. The structure is three-dimensional. Eu+2.50+ is bonded in a 9-coordinate geometry to nine Pt2- atoms. There are a spread of Eu–Pt bond distances ranging from 3.12–3.48 Å. Mn2+ is bonded to twelve Pt2- atoms to form MnPt12 cuboctahedra that share corners with four equivalent MnPt12 cuboctahedra, faces with four equivalent MnPt12 cuboctahedra, and faces with four equivalent PtMn4Pt8 cuboctahedra. There are a spread of Mn–Pt bond distances ranging from 2.82–2.90 Å. There are four inequivalent Pt2- sites. In the first Pt2- site, Pt2- is bonded in a 12-coordinate geometry to two equivalent Eu+2.50+, two equivalent Mn2+, six Pt2-, and two equivalent P+2.33+ atoms. There are two shorter (2.82 Å) and four longer (2.90 Å) Pt–Pt bond lengths. Both Pt–P bond lengths are 2.44 Å. In the second Pt2- site, Pt2- is bonded in a 12-coordinate geometry to two equivalent Eu+2.50+, two equivalent Mn2+, six Pt2-, and two equivalent P+2.33+ atoms. Both Pt–Pt bond lengths are 2.84 Å. Both Pt–P bond lengths are 2.43 Å. In the third Pt2- site, Pt2- is bonded in a 3-coordinate geometry to five equivalent Eu+2.50+ and three P+2.33+ atoms. All Pt–P bond lengths are 2.36 Å. In the fourth Pt2- site, Pt2- is bonded to four equivalent Mn2+ and eight Pt2- atoms to form distorted PtMn4Pt8 cuboctahedra that share corners with four equivalent PtMn4Pt8 cuboctahedra, faces with four equivalent MnPt12 cuboctahedra, and faces with four equivalent PtMn4Pt8 cuboctahedra. There are two inequivalent P+2.33+ sites. In the first P+2.33+ site, P+2.33+ is bonded in a 5-coordinate geometry to five Pt2- atoms. In the second P+2.33+ site, P+2.33+ is bonded to four equivalent Pt2- atoms to form corner-sharing PPt4 tetrahedra.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Eu2ZnCd by Materials Project

Eu2CdZn is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Eu is bonded in a body-centered cubic geometry to four equivalent Cd and four equivalent Zn atoms. All Eu–Cd bond lengths are 3.38 Å. All Eu–Zn bond lengths are 3.38 Å. Cd is bonded in a body-centered cubic geometry to eight equivalent Eu atoms. Zn is bonded in a body-centered cubic geometry to eight equivalent Eu atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Sr3Eu by Materials Project

Sr3Eu is beta Cu3Ti-like structured and crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. there are two inequivalent Sr sites. In the first Sr site, Sr is bonded to eight Sr and four equivalent Eu atoms to form SrSr8Eu4 cuboctahedra that share corners with twelve equivalent SrSr8Eu4 cuboctahedra, edges with eight equivalent EuSr12 cuboctahedra, edges with sixteen SrSr8Eu4 cuboctahedra, faces with four equivalent EuSr12 cuboctahedra, and faces with fourteen SrSr8Eu4 cuboctahedra. There are four shorter (4.22 Å) and four longer (4.23 Å) Sr–Sr bond lengths. All Sr–Eu bond lengths are 4.22 Å. In the second Sr site, Sr is bonded to eight equivalent Sr and four equivalent Eu atoms to form SrSr8Eu4 cuboctahedra that share corners with four equivalent SrSr8Eu4 cuboctahedra, corners with eight equivalent EuSr12 cuboctahedra, edges with twenty-four SrSr8Eu4 cuboctahedra, faces with six equivalent EuSr12 cuboctahedra, and faces with twelve SrSr8Eu4 cuboctahedra. All Sr–Eu bond lengths are 4.23 Å. Eu is bonded to twelve Sr atoms to form EuSr12 cuboctahedra that share corners with four equivalent EuSr12 cuboctahedra, corners with eight equivalent SrSr8Eu4 cuboctahedra, edges with eight equivalent EuSr12 cuboctahedra, edges with sixteen equivalent SrSr8Eu4 cuboctahedra, faces with four equivalent EuSr12 cuboctahedra, and faces with fourteen SrSr8Eu4 cuboctahedra.

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Materials Data on EuBiPd2 by Materials Project

EuPd2Bi is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Eu is bonded in a body-centered cubic geometry to eight equivalent Pd and six equivalent Bi atoms. All Eu–Pd bond lengths are 3.06 Å. All Eu–Bi bond lengths are 3.54 Å. Pd is bonded in a body-centered cubic geometry to four equivalent Eu and four equivalent Bi atoms. All Pd–Bi bond lengths are 3.06 Å. Bi is bonded in a 8-coordinate geometry to six equivalent Eu and eight equivalent Pd atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on EuGaAu by Materials Project

EuAuGa crystallizes in the monoclinic C2/m space group. The structure is three-dimensional. Eu is bonded in a 12-coordinate geometry to six equivalent Au and six equivalent Ga atoms. There are a spread of Eu–Au bond distances ranging from 3.14–3.45 Å. There are a spread of Eu–Ga bond distances ranging from 3.27–3.42 Å. Au is bonded in a 2-coordinate geometry to six equivalent Eu, one Au, and three equivalent Ga atoms. The Au–Au bond length is 2.96 Å. There are two shorter (2.66 Å) and one longer (3.01 Å) Au–Ga bond lengths. Ga is bonded in a 10-coordinate geometry to six equivalent Eu, three equivalent Au, and one Ga atom. The Ga–Ga bond length is 2.70 Å.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on EuZnGe by Materials Project

EuZnGe crystallizes in the orthorhombic Immm space group. The structure is three-dimensional. Eu is bonded to six equivalent Zn and six equivalent Ge atoms to form a mixture of face and edge-sharing EuZn6Ge6 cuboctahedra. There are two shorter (3.32 Å) and four longer (3.33 Å) Eu–Zn bond lengths. All Eu–Ge bond lengths are 3.32 Å. Zn is bonded in a 2-coordinate geometry to six equivalent Eu, one Zn, and two equivalent Ge atoms. The Zn–Zn bond length is 2.53 Å. Both Zn–Ge bond lengths are 2.51 Å. Ge is bonded in a distorted bent 120 degrees geometry to six equivalent Eu, two equivalent Zn, and one Ge atom. The Ge–Ge bond length is 2.54 Å.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on CaYbEu2 by Materials Project

CaYbEu2 is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Ca is bonded in a body-centered cubic geometry to eight equivalent Eu atoms. All Ca–Eu bond lengths are 3.77 Å. Yb is bonded in a body-centered cubic geometry to eight equivalent Eu atoms. All Yb–Eu bond lengths are 3.77 Å. Eu is bonded in a body-centered cubic geometry to four equivalent Ca and four equivalent Yb atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on EuMg5 by Materials Project

Mg5Eu crystallizes in the hexagonal P-62m space group. The structure is three-dimensional. there are two inequivalent Mg sites. In the first Mg site, Mg is bonded in a distorted q6 geometry to eight Mg and two equivalent Eu atoms. There are four shorter (3.04 Å) and four longer (3.11 Å) Mg–Mg bond lengths. Both Mg–Eu bond lengths are 3.72 Å. In the second Mg site, Mg is bonded to nine Mg and three equivalent Eu atoms to form distorted MgEu3Mg9 cuboctahedra that share corners with nine equivalent MgEu3Mg9 cuboctahedra, corners with nine equivalent EuMg12 cuboctahedra, edges with six equivalent MgEu3Mg9 cuboctahedra, faces with three equivalent EuMg12 cuboctahedra, and faces with five equivalent MgEu3Mg9 cuboctahedra. All Mg–Mg bond lengths are 3.45 Å. All Mg–Eu bond lengths are 3.45 Å. Eu is bonded to twelve Mg atoms to form EuMg12 cuboctahedra that share corners with eighteen equivalent MgEu3Mg9 cuboctahedra, edges with six equivalent EuMg12 cuboctahedra, faces with two equivalent EuMg12 cuboctahedra, and faces with six equivalent MgEu3Mg9 cuboctahedra.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on EuZnGe by Materials Project

EuZnGe crystallizes in the hexagonal P6_3mc space group. The structure is three-dimensional. Eu is bonded in a 12-coordinate geometry to six equivalent Zn and six equivalent Ge atoms. There are three shorter (3.12 Å) and three longer (3.35 Å) Eu–Zn bond lengths. There are three shorter (3.09 Å) and three longer (3.39 Å) Eu–Ge bond lengths. Zn is bonded in a 3-coordinate geometry to six equivalent Eu and three equivalent Ge atoms. All Zn–Ge bond lengths are 2.64 Å. Ge is bonded in a 9-coordinate geometry to six equivalent Eu and three equivalent Zn atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Eu2TlIn by Materials Project

Eu2TlIn is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Eu is bonded in a body-centered cubic geometry to four equivalent Tl and four equivalent In atoms. All Eu–Tl bond lengths are 3.36 Å. All Eu–In bond lengths are 3.36 Å. Tl is bonded in a body-centered cubic geometry to eight equivalent Eu atoms. In is bonded in a body-centered cubic geometry to eight equivalent Eu atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on EuPIr by Materials Project

EuIrP crystallizes in the cubic P2_13 space group. The structure is three-dimensional. Eu is bonded in a 8-coordinate geometry to four equivalent Ir and four equivalent P atoms. There are one shorter (3.25 Å) and three longer (3.26 Å) Eu–Ir bond lengths. There are one shorter (3.04 Å) and three longer (3.15 Å) Eu–P bond lengths. Ir is bonded in a 7-coordinate geometry to four equivalent Eu and three equivalent P atoms. All Ir–P bond lengths are 2.28 Å. P is bonded in a 7-coordinate geometry to four equivalent Eu and three equivalent Ir atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on EuHg2Pb by Materials Project

EuHg2Pb is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Eu is bonded in a distorted body-centered cubic geometry to eight equivalent Hg and six equivalent Pb atoms. All Eu–Hg bond lengths are 3.31 Å. All Eu–Pb bond lengths are 3.82 Å. Hg is bonded in a body-centered cubic geometry to four equivalent Eu and four equivalent Pb atoms. All Hg–Pb bond lengths are 3.31 Å. Pb is bonded in a distorted body-centered cubic geometry to six equivalent Eu and eight equivalent Hg atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Eu2TlSn by Materials Project

Eu2TlSn is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Eu is bonded in a body-centered cubic geometry to four equivalent Tl and four equivalent Sn atoms. All Eu–Tl bond lengths are 3.44 Å. All Eu–Sn bond lengths are 3.44 Å. Tl is bonded in a body-centered cubic geometry to eight equivalent Eu atoms. Sn is bonded in a body-centered cubic geometry to eight equivalent Eu atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Eu5Nb4O15 by Materials Project

Eu5Nb4O15 crystallizes in the triclinic P1 space group. The structure is three-dimensional. there are five inequivalent Eu2+ sites. In the first Eu2+ site, Eu2+ is bonded to twelve O2- atoms to form EuO12 cuboctahedra that share corners with six equivalent EuO12 cuboctahedra, faces with three equivalent EuO12 cuboctahedra, and faces with eight NbO6 octahedra. There are a spread of Eu–O bond distances ranging from 2.81–2.87 Å. In the second Eu2+ site, Eu2+ is bonded in a 12-coordinate geometry to nine O2- atoms. There are a spread of Eu–O bond distances ranging from 2.50–2.92 Å. In the third Eu2+ site, Eu2+ is bonded in a 9-coordinate geometry to nine O2- atoms. There are a spread of Eu–O bond distances ranging from 2.49–2.92 Å. In the fourth Eu2+ site, Eu2+ is bonded in a 12-coordinate geometry to twelve O2- atoms. There are a spread of Eu–O bond distances ranging from 2.51–3.13 Å. In the fifth Eu2+ site, Eu2+ is bonded to twelve O2- atoms to form distorted EuO12 cuboctahedra that share corners with six equivalent EuO12 cuboctahedra, faces with three equivalent EuO12 cuboctahedra, and faces with seven NbO6 octahedra. There are a spread of Eu–O bond distances ranging from 2.52–3.12 Å. There are four inequivalent Nb5+ sites. In the first Nb5+ site, Nb5+ is bonded to six O2- atoms to form NbO6 octahedra that share corners with six NbO6 octahedra and faces with six EuO12 cuboctahedra. The corner-sharing octahedra tilt angles range from 0–8°. There are three shorter (1.99 Å) and three longer (2.05 Å) Nb–O bond lengths. In the second Nb5+ site, Nb5+ is bonded to six O2- atoms to form NbO6 octahedra that share corners with six NbO6 octahedra and faces with four EuO12 cuboctahedra. The corner-sharing octahedra tilt angles range from 0–9°. There are three shorter (1.99 Å) and three longer (2.05 Å) Nb–O bond lengths. In the third Nb5+ site, Nb5+ is bonded to six O2- atoms to form NbO6 octahedra that share corners with three equivalent NbO6 octahedra and faces with four EuO12 cuboctahedra. The corner-sharing octahedral tilt angles are 8°. There are a spread of Nb–O bond distances ranging from 1.91–2.17 Å. In the fourth Nb5+ site, Nb5+ is bonded to six O2- atoms to form NbO6 octahedra that share corners with three equivalent NbO6 octahedra and a faceface with one EuO12 cuboctahedra. The corner-sharing octahedra tilt angles range from 8–9°. There are three shorter (1.91 Å) and three longer (2.17 Å) Nb–O bond lengths. There are fourteen inequivalent O2- sites. In the first O2- site, O2- is bonded in a 1-coordinate geometry to four Eu2+ and one Nb5+ atom. In the second O2- site, O2- is bonded in a 1-coordinate geometry to four Eu2+ and one Nb5+ atom. In the third O2- site, O2- is bonded in a 1-coordinate geometry to four Eu2+ and one Nb5+ atom. In the fourth O2- site, O2- is bonded in a 1-coordinate geometry to four Eu2+ and one Nb5+ atom. In the fifth O2- site, O2- is bonded in a 1-coordinate geometry to four Eu2+ and one Nb5+ atom. In the sixth O2- site, O2- is bonded in a 1-coordinate geometry to four Eu2+ and one Nb5+ atom. In the seventh O2- site, O2- is bonded in a distorted linear geometry to four Eu2+ and two Nb5+ atoms. In the eighth O2- site, O2- is bonded in a distorted linear geometry to four Eu2+ and two Nb5+ atoms. In the ninth O2- site, O2- is bonded in a distorted linear geometry to four Eu2+ and two Nb5+ atoms. In the tenth O2- site, O2- is bonded in a 2-coordinate geometry to three Eu2+ and two Nb5+ atoms. In the eleventh O2- site, O2- is bonded in a 2-coordinate geometry to three Eu2+ and two Nb5+ atoms. In the twelfth O2- site, O2- is bonded in a 2-coordinate geometry to three Eu2+ and two Nb5+ atoms. In the thirteenth O2- site, O2- is bonded in a 2-coordinate geometry to three Eu2+ and two Nb5+ atoms. In the fourteenth O2- site, O2- is bonded in a 2-coordinate geometry to three Eu2+ and two Nb5+ atoms.

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