X-Ray Diffraction Table

X-Ray Diffraction Table

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Minerals Arranged by X-Ray Powder Diffraction

See Help on X-Ray Diffraction.

Powder X-ray Diffraction (XRD) is one of the primary techniques used by mineralogists and solid state chemists to examine the physico-chemical make-up of unknown materials. This data is represented in a collection of single-phase X-ray powder diffraction patterns for the three most intense D values in the form of tables of interplanar spacings (D), relative intensities (I/Io), mineral name and chemical formulae

The XRD technique takes a sample of the material and places a powdered sample in a holder, then the sample is illuminated with x-rays of a fixed wave-length and the intensity of the reflected radiation is recorded using a goniometer. This data is then analyzed for the reflection angle to calculate the inter-atomic spacing (D value in Angstrom units - 10-8 cm). The intensity(I) is measured to discriminate (using I ratios) the various D spacings and the results are compared to this table to identify possible matches. Note: 2 theta (Θ) angle calculated from the Bragg Equation, 2 Θ = 2(arcsin(n λ/(2d)) where n=1;

For more information about this technique, see X-Ray Analysis of a Solid or take an internet course at Birkbeck College On-line Courses.  Many thanks to Frederic Biret for these data.

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Listing of 244 Records Sorted by D1 using 1.54056 - CuKa1 for 2θ WHERE (d1 > 2.5235 AND d1 < 2.6265)
D1
Å (2θ)
I1
%)
D2
Å (2θ)
I2
(%)
D3
Å (2θ)
I3
(%)
Mineral Formula
2.525(35.52) 100 2.960(30.17) 40 1.481(62.68) 35 Magnesioferrite MgFe+++2O4
2.529(35.47) 100 8.048(10.98) 90 2.098(43.08) 63 Hogtuvaite (Ca,Na)2(Fe++,Fe+++,Ti,Mg,Mn)6(Si,Be,Al)6O20
2.530(35.45) 100 2.900(30.81) 80 2.560(35.02) 80 Serendibite Ca2(Mg,Al)6(Si,Al,B)6O20
2.530(35.45) 100 7.324(12.07) 70 2.910(30.70) 70 Welshite Ca4Mg9Sb3O4[Si6Be3AlFe2O36]
2.530(35.45) 100 3.300(27.00) 100 3.160(28.22) 100 Odintsovite K2Na4Ca3Ti2Be4Si12O38
2.530(35.45) 100 3.460(25.73) 80 2.750(32.53) 80 Xanthiosite Ni3(AsO4)2
2.530(35.45) 100 7.290(12.13) 100 3.610(24.64) 80 Antigorite (Mg,Fe++)3Si2O5(OH)4
2.530(35.45) 100 4.500(19.71) 89 3.160(28.22) 72 Potassicleakeite KNa2Mg2Fe+++2LiSi8O22(OH)2
2.530(35.45) 100 3.160(28.22) 100 3.300(27.00) 100 Odintsovite K2Na4Ca3Ti2Be4Si12O38
2.530(35.45) 100 2.910(30.70) 100 3.730(23.84) 80 Thalcusite TlCu3FeS4
2.530(35.45) 100 2.910(30.70) 70 7.324(12.07) 70 Welshite Ca4Mg9Sb3O4[Si6Be3AlFe2O36]
2.530(35.45) 100 2.810(31.82) 70 4.860(18.24) 60 Kuznetsovite Hg3Cl(AsO4)
2.530(35.45) 100 2.750(32.53) 80 3.460(25.73) 80 Xanthiosite Ni3(AsO4)2
2.530(35.45) 100 2.676(33.46) 77 2.924(30.55) 69 Makarochkinite Ca2Fe++4Fe+++TiSi4BeAlO20
2.530(35.45) 100 2.560(35.02) 80 2.900(30.81) 80 Serendibite Ca2(Mg,Al)6(Si,Al,B)6O20
2.530(35.45) 100 1.486(62.44) 60 1.617(56.90) 50 Qandilite (Mg,Fe++)2(Ti,Fe+++,Al)O4
2.530(35.45) 100 1.483(62.58) 85 1.614(57.01) 85 Magnetite Fe++Fe+++2O4
2.530(35.45) 100 1.614(57.01) 85 1.483(62.58) 85 Magnetite Fe++Fe+++2O4
2.531(35.44) 100 2.427(37.01) 80 2.422(37.09) 80 Clinosafflorite (Co,Fe,Ni)As2
2.531(35.44) 100 2.422(37.09) 80 2.427(37.01) 80 Clinosafflorite (Co,Fe,Ni)As2
2.531(35.44) 100 2.892(30.89) 70 4.139(21.45) 50 Abhurite Sn3O(OH)2Cl2
2.532(35.42) 100 4.390(20.21) 80 2.774(32.24) 80 Reederite-(Y) Na15Y2(CO3)9(SO3F)Cl
2.532(35.42) 100 2.774(32.24) 80 4.390(20.21) 80 Reederite-(Y) Na15Y2(CO3)9(SO3F)Cl
2.532(35.42) 100 2.001(45.28) 54 2.618(34.22) 50 Aluminomagnesiohulsite Mg2(Al,Mg,Sn)(BO3)O2
2.533(35.41) 100 2.720(32.90) 35 1.462(63.59) 35 Macaulayite (Fe+++,Al)24Si4O43(OH)2
2.533(35.41) 100 1.462(63.59) 35 2.720(32.90) 35 Macaulayite (Fe+++,Al)24Si4O43(OH)2
2.535(35.38) 100 7.000(12.64) 85 3.502(25.41) 85 Kellyite (Mn++,Mg,Al)3(Si,Al)2O5(OH)4
2.535(35.38) 100 3.502(25.41) 85 7.000(12.64) 85 Kellyite (Mn++,Mg,Al)3(Si,Al)2O5(OH)4
2.536(35.36) 100 2.714(32.98) 87 3.361(26.50) 71 Fangite Tl3AsS4
2.537(35.35) 100 2.550(35.16) 85 8.438(10.48) 80 IMA2008-048 Zn6(PO4)4•7H2O
2.540(35.31) 100 4.670(18.99) 90 5.210(17.00) 80 Nastrophite Na(Sr,Ba)(PO4)•9(H2O)
2.540(35.31) 100 1.800(50.67) 63 5.900(15.00) 63 Lawrencite (Fe++,Ni)Cl2
2.540(35.31) 100 2.650(33.80) 85 3.890(22.84) 48 Radtkeite Hg3S2ClI
2.540(35.31) 100 5.900(15.00) 63 1.800(50.67) 63 Lawrencite (Fe++,Ni)Cl2
2.540(35.31) 100 3.528(25.22) 100 2.816(31.75) 100 Junitoite CaZn2Si2O7•(H2O)
2.540(35.31) 100 4.290(20.69) 90 3.510(25.35) 90 Triphylite LiFe++PO4
2.540(35.31) 100 3.510(25.35) 90 4.290(20.69) 90 Triphylite LiFe++PO4
2.540(35.31) 100 2.816(31.75) 100 3.528(25.22) 100 Junitoite CaZn2Si2O7•(H2O)
2.540(35.31) 100 1.484(62.54) 90 1.615(56.97) 70 Brunogeierite (Ge++,Fe++)Fe+++2O4
2.540(35.31) 100 1.470(63.20) 80 2.230(40.41) 50 Feroxyhyte Fe+++O(OH)
2.545(35.24) 100 2.828(31.61) 88 3.188(27.96) 85 Cobaltlotharmeyerite Ca(Co,Fe,Ni)2(AsO4)2(OH,H2O)2
2.545(35.24) 100 2.325(38.70) 90 1.716(53.34) 80 Gersdorffite NiAsS
2.545(35.24) 100 2.640(33.93) 100 2.935(30.43) 80 Kullerudite NiSe2
2.547(35.21) 100 4.456(19.91) 90 1.486(62.44) 90 Saliotite Na0.5Li0.5Al3AlSi3O10(OH)5
2.547(35.21) 100 5.090(17.41) 70 5.750(15.40) 70 Donharrisite Ni8Hg3S9
2.547(35.21) 100 5.750(15.40) 70 5.090(17.41) 70 Donharrisite Ni8Hg3S9
2.547(35.21) 100 1.486(62.44) 90 4.456(19.91) 90 Saliotite Na0.5Li0.5Al3AlSi3O10(OH)5
2.548(35.19) 100 2.514(35.68) 100 5.100(17.37) 50 Bonaccordite Ni2Fe+++BO5
2.548(35.19) 100 3.051(29.25) 90 3.516(25.31) 50 Lithiophilite LiMnPO4
2.549(35.18) 100 5.890(15.03) 90 5.090(17.41) 90 Dumortierite Al6.5-7(BO3)(SiO4)3(O,OH)3
2.549(35.18) 100 5.090(17.41) 90 5.890(15.03) 90 Dumortierite Al6.5-7(BO3)(SiO4)3(O,OH)3
2.550(35.16) 100 4.520(19.62) 100 2.610(34.33) 100 Beidellite Na0.5Al2(Si3.5Al0.5)O10(OH)2•n(H2O)
2.550(35.16) 100 12.300(7.18) 100 4.160(21.34) 100 Stilpnomelane K(Fe++,Mg,Fe+++)8(Si,Al)12(O,OH)27•n(H2O)
2.550(35.16) 100 1.630(56.40) 70 1.500(61.80) 60 Manganochromite (Mn,Fe++)(Cr,V)2O4
2.550(35.16) 100 3.390(26.27) 46 4.860(18.24) 37 Schwertmannite Fe+++16O16(OH)12(SO4)2
2.550(35.16) 100 4.160(21.34) 100 12.300(7.18) 100 Stilpnomelane K(Fe++,Mg,Fe+++)8(Si,Al)12(O,OH)27•n(H2O)
2.550(35.16) 100 3.890(22.84) 100 2.810(31.82) 80 Fiedlerite Pb3Cl4F(OH)2
2.550(35.16) 100 3.080(28.97) 100 3.480(25.58) 90 Prehnite Ca2Al2Si3O10(OH)2
2.550(35.16) 100 2.980(29.96) 100 1.955(46.41) 90 Balkanite Cu9Ag5HgS8
2.550(35.16) 100 2.890(30.92) 90 2.600(34.47) 80 Nierite Si3N4
2.550(35.16) 100 2.740(32.65) 90 2.800(31.94) 80 Langbanite (Mn,Ca,Fe)++4(Mn+++,Fe+++)9Sb+++++Si2O24
2.550(35.16) 100 2.610(34.33) 100 4.520(19.62) 100 Beidellite Na0.5Al2(Si3.5Al0.5)O10(OH)2•n(H2O)
2.550(35.16) 100 2.690(33.28) 80 5.900(15.00) 50 Chlormanganokalite K4MnCl6
2.550(35.16) 100 1.499(61.84) 80 2.990(29.86) 70 Franklinite (Zn,Mn++,Fe++)(Fe+++,Mn+++)2O4
2.551(35.15) 100 3.430(25.96) 80 3.950(22.49) 70 Olenite NaAl3Al6(BO3)3(Si6O18)(O,OH)4
2.552(35.14) 100 2.476(36.25) 90 2.843(31.44) 65 Rammelsbergite NiAs2
2.552(35.14) 100 1.677(54.69) 60 1.723(53.11) 50 Nelenite (Mn,Fe++)16Si12As+++3O36(OH)17
2.555(35.09) 100 2.035(44.48) 80 5.813(15.23) 80 Paracostibite CoSbS
2.555(35.09) 100 2.718(32.93) 100 4.930(17.98) 80 Manganlotharmeyerite Ca(Mn+++,Mg,)2(AsO4)2(OH,H2O)2
2.555(35.09) 100 5.813(15.23) 80 2.035(44.48) 80 Paracostibite CoSbS
2.555(35.09) 100 3.182(28.02) 100 2.718(32.93) 80 Manganlotharmeyerite Ca(Mn+++,Mg,)2(AsO4)2(OH,H2O)2
2.556(35.08) 100 2.010(45.07) 60 2.823(31.67) 50 Suanite Mg2B2O5
2.556(35.08) 100 1.544(59.85) 100 2.992(29.84) 60 Glagolevite NaMg6[Si3AlO10](OH,O)8•H2O
2.557(35.06) 100 1.806(50.49) 100 2.869(31.15) 78 Jerrygibbsite (Mn,Zn)9(SiO4)4(OH)2
2.557(35.06) 100 3.414(26.08) 90 3.175(28.08) 90 Lotharmeyerite CaZnMn+++(AsO3OH)4(OH)3
2.557(35.06) 100 3.175(28.08) 90 3.414(26.08) 90 Lotharmeyerite CaZnMn+++(AsO3OH)4(OH)3
2.557(35.06) 100 6.810(12.99) 45 2.267(39.73) 35 Rorisite (Ca,Mg)FCl
2.558(35.05) 100 3.119(28.60) 100 1.560(59.18) 80 Harrisonite Ca(Fe++,Mg)6(PO4)2(SiO4)2
2.559(35.04) 100 2.521(35.58) 95 2.371(37.92) 65 Pararammelsbergite NiAs2
2.559(35.04) 100 4.050(21.93) 90 12.200(7.24) 80 Philipsburgite (Cu,Zn)6(AsO4,PO4)2(OH)6•(H2O)
2.559(35.04) 100 1.502(61.71) 80 1.633(56.29) 40 Vuorelainenite (Mn++,Fe++)(V+++,Cr+++)2O4
2.560(35.02) 100 2.860(31.25) 85 3.610(24.64) 85 Tephroite Mn2SiO4
2.560(35.02) 100 2.660(33.67) 100 2.230(40.41) 60 Naumannite Ag2Se
2.560(35.02) 100 7.160(12.35) 70 2.888(30.94) 60 Mcgillite (Mn,Fe++)8Si6O15(OH)8Cl2
2.560(35.02) 100 1.912(47.51) 80 1.410(66.23) 70 Gudmundite FeSbS
2.560(35.02) 100 1.527(60.59) 70 1.662(55.22) 60 Filipstadite (Mn++,Mg)4Sb+++++Fe+++O8
2.560(35.02) 100 2.110(42.82) 70 3.210(27.77) 70 Clintonite Ca(Mg,Al)3(Al3Si)O10(OH)2
2.560(35.02) 100 3.210(27.77) 70 2.110(42.82) 70 Clintonite Ca(Mg,Al)3(Al3Si)O10(OH)2
2.560(35.02) 100 7.100(12.46) 90 3.548(25.08) 60 Cronstedtite Fe++2Fe+++(SiFe+++)O5(OH)4
2.560(35.02) 100 3.610(24.64) 85 2.860(31.25) 85 Tephroite Mn2SiO4
2.560(35.02) 100 7.170(12.33) 90 3.600(24.71) 70 Friedelite Mn8Si6O15(OH,Cl)10
2.560(35.02) 100 2.220(40.60) 90 1.574(58.60) 80 Niobocarbide (Nb,Ta)C
2.562(34.99) 100 4.960(17.87) 70 5.520(16.04) 70 Shortite Na2Ca2(CO3)3
2.562(34.99) 100 5.520(16.04) 70 4.960(17.87) 70 Shortite Na2Ca2(CO3)3
2.562(34.99) 100 2.489(36.06) 100 4.720(18.78) 100 Cornubite Cu5(AsO4)2(OH)4
2.563(34.98) 100 1.503(61.66) 40 3.005(29.71) 35 Jacobsite (Mn++,Fe++,Mg)(Fe+++,Mn+++)2O4
2.567(34.92) 100 3.969(22.38) 100 4.211(21.08) 90 Magnesiofoitite [ ](Mg2Al)Al6(Si6O18)(BO3)3(OH)4
2.569(34.90) 100 1.540(60.02) 50 2.873(31.10) 40 Almandine Fe++3Al2(SiO4)3
2.570(34.88) 100 1.506(61.52) 40 3.016(29.59) 40 Iwakiite Mn++(Fe+++,Mn+++)2O4
2.570(34.88) 100 4.176(21.26) 38 2.957(30.20) 30 Yuanfuliite (Mg,Fe++)(Fe+++,Al,Mg,Ti,Fe++)(BO3)O

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