AFLOW Prototype: ABC2_hR4_166_a_b_c-009
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| Prototype | FeNaO$_{2}$ |
| AFLOW prototype label | ABC2_hR4_166_a_b_c-009 |
| ICSD | 187705 |
| CCDC | 1696781 |
| Pearson symbol | hR4 |
| Space group number | 166 |
| Space group symbol | $R\overline{3}m$ |
| AFLOW prototype command |
aflow --proto=ABC2_hR4_166_a_b_c-009
--params=$a, \allowbreak c/a, \allowbreak x_{3}$ |
AgAlO$_{2}$, AgAsSe$_{2}$, AgBiSe$_{2}$, AgBiTe$_{2}$, AgGaO$_{2}$, AgInS$_{2}$, AgInSe$_{2}$, AgSbTe$_{2}$, AlLiSe$_{2}$, AsICa$_{2}$, BeSiN$_{2}$, BiRbS$_{2}$, BiTlSe$_{2}$, BrNZn$_{2}$, CeRbO$_{2}$, CeRbS$_{2}$, CeRbSe$_{2}$, CeRbTe$_{2}$, ClCLa$_{2}$, ClNSr$_{2}$, ClNZn$_{2}$, CoLiO$_{2}$, CsCeS$_{2}$, CsCeSe$_{2}$, CsDyS$_{2}$, CsErS$_{2}$, CsEuS$_{2}$, CsGdS$_{2}$, CsHoS$_{2}$, CsLaS$_{2}$, CsLaSe$_{2}$, CsLuS$_{2}$, CsNdO$_{2}$, CsNdS$_{2}$, CsNdSe$_{2}$, CsNdTe$_{2}$, CsPrS$_{2}$, CsPrSe$_{2}$, CsSmS$_{2}$, CsSmSe$_{2}$, CsTbS$_{2}$, CsTmS$_{2}$, CsYO$_{2}$, CsYbS$_{2}$, CsYbSe$_{2}$, CuGaO$_{2}$, DNSr$_{2}$, DyTlS$_{2}$, ErNaSe$_{2}$, ErTlS$_{2}$, EuNaSe$_{2}$, Gd$_{2}$ClC, GdNaS$_{2}$, GdNaSe$_{2}$, GdTlS$_{2}$, GdTlSe$_{2}$, GdTlTe$_{2}$, GeZnN$_{2}$, HoNaS$_{2}$, HoNaSe$_{2}$, HoTe$_{2}$Tl, HoTlS$_{2}$, HoTlSe$_{2}$, InKO$_{2}$, InNaS$_{2}$, InNaSSe, InTlS$_{2}$, KBiS$_{2}$, KBiSe$_{2}$, KCeS$_{2}$, KCeSe$_{2}$, KCrO$_{2}$, KCrS$_{2}$, KDyS$_{2}$, KErO$_{2}$, KErS$_{2}$, KErTe$_{2}$, KEuS$_{2}$, KGdS$_{2}$, KGdSe$_{2}$, KGdTe$_{2}$, KHoS$_{2}$, KHoSe$_{2}$, KLaO$_{2}$, KLaS$_{2}$, KLaSe$_{2}$, KLaTe$_{2}$, KLuS$_{2}$, KLuSe$_{2}$, KLuTe$_{2}$, KNdS$_{2}$, KNdSe$_{2}$, KNdTe$_{2}$, KPrO$_{2}$, KPrS$_{2}$, KPrSe$_{2}$, KPrTe$_{2}$, KScO$_{2}$, KScS$_{2}$, KScTe$_{2}$, KSmS$_{2}$, KSmTe$_{2}$, KSnS$_{2}$, KTbS$_{2}$, KTiS$_{2}$, KTlO$_{2}$, KTmS$_{2}$, KTmSe$_{2}$, KTmTe$_{2}$, KYO$_{2}$, KYS$_{2}$, KYTe$_{2}$, KYbS$_{2}$, KYbSe$_{2}$, KZrS$_{2}$, LaNaSe$_{2}$, LiAlO$_{2}$, LiCoO$_{2}$, LiCrO$_{2}$, LiDyS$_{2}$, LiDySe$_{2}$, LiErS$_{2}$, LiErSe$_{2}$, LiFeO$_{2}$, LiGaO$_{2}$, LiGaS$_{2}$, LiGaSe$_{2}$, LiGdSe$_{2}$, LiHoS$_{2}$, LiHoSe$_{2}$, LiHoTe$_{2}$, LiInSe$_{2}$, LiLuSe$_{2}$, LiLuTe$_{2}$, LiMoO$_{2}$, LiNi$_{2}$, LiNiO$_{2}$, LiScS$_{2}$, LiScSe$_{2}$, LiSnS$_{2}$, LiTbSe$_{2}$, LiTiS$_{2}$, LiTmSe$_{2}$, LiTmTe$_{2}$, LiVO$_{2}$, LiYS$_{2}$, LiYSe$_{2}$, LiYbS$_{2}$, LuTlS$_{2}$, LuTlSe$_{2}$, LuTlTe$_{2}$, MgGeN$_{2}$, MgSiN$_{2}$, MnGeN$_{2}$, MnSiN$_{2}$, NBrBa$_{2}$, NBrCa$_{2}$, NBrSr$_{2}$, NBrZn$_{2}$, NClBa$_{2}$, NClCa$_{2}$, NClMg$_{2}$, NClSr$_{2}$, NClZn$_{2}$, NFBa$_{2}$, NISr$_{2}$, NaAlO$_{2}$, NaCeSe$_{2}$, NaCoO$_{2}$, NaCrO$_{2}$, NaCrS$_{2}$, NaCrSe$_{2}$, NaDyS$_{2}$, NaDySe$_{2}$, NaErO$_{2}$, NaErS$_{2}$, NaErSe$_{2}$, NaEuS$_{2}$, NaFeO$_{2}$, NaGaO$_{2}$, NaGdS$_{2}$, NaGdSe$_{2}$, NaHoO$_{2}$, NaHoS$_{2}$, NaHoSe$_{2}$, NaInO$_{2}$, NaInS$_{2}$, NaInSe$_{2}$, NaLuS$_{2}$, NaLuTe$_{2}$, NaMoO$_{2}$, NaNbN$_{2}$, NaNdS$_{2}$, NaNdSe$_{2}$, NaPrSe$_{2}$, NaRhO$_{2}$, NaRuO$_{2}$, NaScO$_{2}$, NaScS$_{2}$, NaScSe$_{2}$, NaScTe$_{2}$, NaSmS$_{2}$, NaSmSe$_{2}$, NaSnS$_{2}$, NaTaN$_{2}$, NaTbS$_{2}$, NaTbSe$_{2}$, NaTiO$_{2}$, NaTiS$_{2}$, NaTlO$_{2}$, NaTmS$_{2}$, NaTmTe$_{2}$, NaVO$_{2}$, NaVS$_{2}$, NaVSe$_{2}$, NaYO$_{2}$, NaYS$_{2}$, NaYSe$_{2}$, NaYbO$_{2}$, NaYbS$_{2}$, NaYbSe$_{2}$, NaYbSe$_{2}$, NdRbTe$_{2}$, NdTlS$_{2}$, NdTlSe$_{2}$, NdTlTe$_{2}$, PBrEu$_{2}$, PClBa$_{2}$, PICa$_{2}$, PIEu$_{2}$, PrTlSe$_{2}$, PrTlTe$_{2}$, RbCeS$_{2}$, RbCeSe$_{2}$, RbCeTe$_{2}$, RbDyO$_{2}$, RbDyS$_{2}$, RbErO$_{2}$, RbErS$_{2}$, RbErSe$_{2}$, RbEuO$_{2}$, RbEuS$_{2}$, RbGdO$_{2}$, RbGdS$_{2}$, RbGdSe$_{2}$, RbHoO$_{2}$, RbHoS$_{2}$, RbHoSe$_{2}$, RbHoTe$_{2}$, RbLaO$_{2}$, RbLaS$_{2}$, RbLaSe$_{2}$, RbLuO$_{2}$, RbLuS$_{2}$, RbLuSe$_{2}$, RbLuTe$_{2}$, RbNdO$_{2}$, RbNdS$_{2}$, RbNdSe$_{2}$, RbPrS$_{2}$, RbPrSe$_{2}$, RbScO$_{2}$, RbScS$_{2}$, RbSmO$_{2}$, RbSmS$_{2}$, RbSmSe$_{2}$, RbSnS$_{2}$, RbTbS$_{2}$, RbTbSe$_{2}$, RbTlO$_{2}$, RbTmO$_{2}$, RbTmS$_{2}$, RbYO$_{2}$, RbYS$_{2}$, RbYTe$_{2}$, RbYbO$_{2}$, RbYbS$_{2}$, RhLiO$_{2}$, SbTlTe$_{2}$, SmTlS$_{2}$, SmTlSe$_{2}$, SmTlTe$_{2}$, SrCeN$_{2}$, SrHfN$_{2}$, SrZrN$_{2}$, TbTlS$_{2}$, TbTlSe$_{2}$, TbTlTe$_{2}$, TlBiS$_{2}$, TlBiSe$_{2}$, TlBiTe$_{2}$, TlDyS$_{2}$, TlDySe$_{2}$, TlDyTe$_{2}$, TlErS$_{2}$, TlErSe$_{2}$, TlErTe$_{2}$, TlEuS$_{2}$, TlGdSe$_{2}$, TlHoSe$_{2}$, TlInS$_{2}$, TlNdSe$_{2}$, TlSbTe$_{2}$, TlScSe$_{2}$, TlScTe$_{2}$, TlTbSe$_{2}$, TlTmS$_{2}$, TlTmSe$_{2}$, TlTmTe$_{2}$, TlYS$_{2}$, TlYSe$_{2}$, TlYTe$_{2}$, TlYbS$_{2}$, TlYbSe$_{2}$, ZnGeN$_{2}$, ZnSiN$_{2}$
--params) specified in their corresponding CIF files. --hex. Basis vectors
| Lattice coordinates | Cartesian coordinates | Wyckoff position | Atom type | |||
|---|---|---|---|---|---|---|
| $\mathbf{B_{1}}$ | = | $0$ | = | $0$ | (1a) | Fe I |
| $\mathbf{B_{2}}$ | = | $\frac{1}{2} \, \mathbf{a}_{1}+\frac{1}{2} \, \mathbf{a}_{2}+\frac{1}{2} \, \mathbf{a}_{3}$ | = | $\frac{1}{2}c \,\mathbf{\hat{z}}$ | (1b) | Na I |
| $\mathbf{B_{3}}$ | = | $x_{3} \, \mathbf{a}_{1}+x_{3} \, \mathbf{a}_{2}+x_{3} \, \mathbf{a}_{3}$ | = | $c x_{3} \,\mathbf{\hat{z}}$ | (2c) | O I |
| $\mathbf{B_{4}}$ | = | $- x_{3} \, \mathbf{a}_{1}- x_{3} \, \mathbf{a}_{2}- x_{3} \, \mathbf{a}_{3}$ | = | $- c x_{3} \,\mathbf{\hat{z}}$ | (2c) | O I |