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 228 Records Sorted by D1 using 1.54056 - CuKa1 for 2θ WHERE (d1 > 3.3908 AND d1 < 3.5292)
D1
Å (2θ)
I1
%)
D2
Å (2θ)
I2
(%)
D3
Å (2θ)
I3
(%)
Mineral Formula
3.392(26.25) 100 3.114(28.64) 90 2.084(43.38) 33 Joelbruggerite Pb3Zn3Sb+++++As2O13(OH)
3.392(26.25) 100 3.210(27.77) 82 2.230(40.41) 69 Vistepite Mn++4Sn++++B2(SiO4)4(OH)2
3.393(26.24) 100 2.724(32.85) 70 8.137(10.86) 60 Humberstonite K3Na7Mg2(SO4)6(NO3)2•6(H2O)
3.393(26.24) 100 3.120(28.59) 85 3.188(27.96) 65 Vonbezingite Ca6Cu3(SO4)3(OH)12•2(H2O)
3.395(26.23) 100 2.819(31.72) 53 2.739(32.67) 48 Tsugaruite Pb4As2S7
3.395(26.23) 100 2.554(35.11) 90 2.925(30.54) 80 Gormanite Fe++3Al4(PO4)4(OH)6•2(H2O)
3.396(26.22) 100 1.977(45.86) 65 3.273(27.22) 52 Aragonite CaCO3
3.396(26.22) 100 2.848(31.38) 31 2.078(43.52) 29 Pertlikite K2(Fe++,Mg)2(Mg,Fe+++)4Fe+++2Al(SO4)12•18H2O
3.396(26.22) 100 3.355(26.55) 90 2.720(32.90) 80 Madocite Pb17(Sb,As)16S41
3.398(26.20) 100 3.175(28.08) 100 2.938(30.40) 100 Ferrilotharmeyerite Ca(Zn,Cu++)(Fe+++,Zn)(AsO4)2(OH,H2O)2
3.399(26.20) 100 3.892(22.83) 70 2.962(30.15) 50 Macfallite Ca2(Mn+++,Al)3(SiO4)(Si2O7)(OH)3
3.400(26.19) 100 2.080(43.47) 40 2.320(38.78) 40 Monsmedite H8K2Tl2(SO4)8•11(H2O)
3.400(26.19) 100 3.090(28.87) 100 2.990(29.86) 100 Epididymite NaBeSi3O7(OH)
3.400(26.19) 100 3.380(26.35) 100 2.000(45.30) 100 Ardaite Pb19Sb13S35Cl7
3.400(26.19) 100 2.080(43.47) 40 1.570(58.76) 40 Monsmedite H8K2Tl2(SO4)8•11(H2O)
3.400(26.19) 100 5.540(15.98) 90 2.859(31.26) 80 Formicaite Ca(HCOO)2
3.400(26.19) 100 5.310(16.68) 70 2.654(33.74) 59 Turkestanite Th(Ca,Na)2(K1-x,[ ]x)Si8O20•n(H2O)
3.400(26.19) 100 4.900(18.09) 90 3.680(24.16) 80 Dashkovaite Mg(HCOO)2•2(H2O)
3.400(26.19) 100 3.860(23.02) 98 2.910(30.70) 74 Armenite BaCa2Al6Si9O30•2(H2O)
3.400(26.19) 100 3.520(25.28) 80 2.710(33.03) 70 Tintinaite Pb22Cu+4(Sb,Bi)30S69
3.400(26.19) 100 2.640(33.93) 60 2.280(39.49) 50 Manganite MnO(OH)
3.400(26.19) 100 2.558(35.05) 60 2.050(44.14) 50 Kuranakhite PbMn++++Te++++++O6
3.400(26.19) 100 1.750(52.23) 90 2.060(43.92) 80 Vikingite Ag5Pb8Bi13S30
3.400(26.19) 100 1.570(58.76) 40 2.080(43.47) 40 Monsmedite H8K2Tl2(SO4)8•11(H2O)
3.400(26.19) 100 2.800(31.94) 80 4.160(21.34) 50 Jagoite (Pb,Na,Ca)3(Fe+++,Mg)Si3O10(Cl,OH)
3.400(26.19) 100 3.040(29.36) 90 9.670(9.14) 80 Jamesite Pb2Zn2Fe+++5(AsO4)5O4
3.400(26.19) 100 2.840(31.47) 90 1.740(52.55) 60 Hallimondite Pb2(UO2)(AsO4)2
3.402(26.17) 100 3.369(26.43) 74 2.815(31.76) 70 Rouxelite Cu2HgPb22Sb28S64(O,S)2
3.405(26.15) 100 3.062(29.14) 56 2.513(35.70) 49 Cobaltkieserite CoSO4•H2O
3.406(26.14) 100 3.050(29.26) 100 4.000(22.21) 100 Calciouranoite (Ca,Ba,Pb)U2O7•5(H2O)
3.409(26.12) 100 4.840(18.31) 90 3.331(26.74) 90 Kieserite MgSO4•(H2O)
3.409(26.12) 100 3.331(26.74) 90 4.840(18.31) 90 Kieserite MgSO4•(H2O)
3.410(26.11) 40 2.520(35.60) 40 9.970(8.86) 40 Montdorite (K,Na)(Fe++,Mn++,Mg)2.5[Si4O10](F,OH)2
3.410(26.11) 100 2.040(44.37) 70 1.750(52.23) 70 Usovite Ba2CaMgAl2F14
3.410(26.11) 100 1.750(52.23) 70 2.040(44.37) 70 Usovite Ba2CaMgAl2F14
3.410(26.11) 100 2.850(31.36) 40 2.940(30.38) 30 Heyrovskyite Pb10AgBi5S18
3.410(26.11) 100 5.570(15.90) 90 2.900(30.81) 80 Wairakite CaAl2Si4O12•2(H2O)
3.410(26.11) 100 3.260(27.33) 80 3.060(29.16) 75 Avogadrite (K,Cs)BF4
3.410(26.11) 100 2.270(39.67) 50 6.830(12.95) 40 Cerotungstite-(Ce) (Ce,REE)W2O6(OH)3
3.410(26.11) 100 2.090(43.25) 40 2.850(31.36) 30 Heyrovskyite Pb10AgBi5S18
3.411(26.10) 100 3.252(27.40) 83 5.260(16.84) 68 Sazhinite-(La) Na3La[Si6O15]•2(H2O)
3.412(26.09) 100 2.721(32.89) 60 2.031(44.58) 60 Sakharovaite (Pb,Fe)(Bi,Sb)2S4
3.412(26.09) 100 2.031(44.58) 60 2.721(32.89) 60 Sakharovaite (Pb,Fe)(Bi,Sb)2S4
3.414(26.08) 100 2.014(44.97) 80 2.893(30.88) 70 Eclarite Pb9(Cu,Fe)Bi12S28
3.414(26.08) 100 10.130(8.72) 100 3.198(27.87) 80 Sidpietersite Pb++4(S++++++O3S--)O2(OH)2
3.416(26.06) 100 2.927(30.52) 64 3.186(27.98) 40 Lukrahnite Ca(Cu,Zn)(Fe,Zn)(AsO4)2(OH,H2O)2
3.418(26.05) 100 2.763(32.38) 95 2.358(38.13) 73 Leningradite PbCu++3(VO4)2Cl2
3.420(26.03) 100 4.770(18.59) 55 3.070(29.06) 45 Gunningite (Zn,Mn)SO4•(H2O)
3.420(26.03) 100 3.370(26.43) 65 2.200(40.99) 60 Sillimanite Al2SiO5 = Al[6]Al[4]OSiO4
3.420(26.03) 100 1.903(47.75) 80 2.455(36.57) 70 Brannerite (U,Ca,Ce)(Ti,Fe)2O6
3.421(26.02) 100 2.907(30.73) 100 3.652(24.35) 80 Pollucite (Cs,Na)2Al2Si4O12•(H2O)
3.423(26.01) 100 4.020(22.09) 38 3.562(24.98) 31 Pellouxite (Cu,Ag)Pb10Sb12S27(Cl,S)0.6O
3.424(26.00) 100 5.085(17.43) 64 3.405(26.15) 27 IMA2008-022 UO2(OH)2
3.426(25.99) 100 3.289(27.09) 100 4.037(22.00) 90 Eztlite Pb2Fe+++6(Te++++O3)3(Te++++++O6)(OH)10•8(H2O)
3.426(25.99) 100 3.378(26.36) 88 2.941(30.37) 54 Aschamalmite Pb6Bi2S9
3.427(25.98) 100 3.312(26.90) 80 3.042(29.34) 80 Izoklakeite Pb27(Cu,Fe)2(Sb,Bi)19S57
3.427(25.98) 100 2.017(44.90) 80 2.753(32.50) 75 Moeloite Pb6Sb6S14(S3)
3.427(25.98) 100 3.042(29.34) 80 3.312(26.90) 80 Izoklakeite Pb27(Cu,Fe)2(Sb,Bi)19S57
3.427(25.98) 100 2.753(32.50) 80 2.779(32.18) 75 Moeloite Pb6Sb6S14(S3)
3.428(25.97) 100 3.441(25.87) 100 3.206(27.80) 80 Chervetite Pb2V2O7
3.428(25.97) 100 5.500(16.10) 64 1.713(53.44) 61 Eugsterite Na4Ca(SO4)3•2(H2O)
3.430(25.96) 100 3.750(23.71) 60 2.734(32.73) 50 Gratonite Pb9As4S15
3.430(25.96) 100 2.813(31.78) 35 3.700(24.03) 35 Jamesonite Pb4FeSb6S14
3.430(25.96) 100 5.610(15.78) 80 2.925(30.54) 80 Analcime NaAlSi2O6•(H2O)
3.430(25.96) 100 2.925(30.54) 80 5.610(15.78) 80 Analcime NaAlSi2O6•(H2O)
3.430(25.96) 100 3.190(27.95) 65 2.308(38.99) 60 Pellyite Ba2Ca(Fe++,Mg)2Si6O17
3.430(25.96) 100 3.210(27.77) 35 2.683(33.37) 30 Bradaczekite NaCu4(AsO4)3
3.430(25.96) 100 8.330(10.61) 60 2.720(32.90) 50 Ungemachite K3Na8Fe+++(SO4)6(NO3)2•6(H2O)
3.430(25.96) 100 3.700(24.03) 35 2.813(31.78) 35 Jamesonite Pb4FeSb6S14
3.430(25.96) 100 3.050(29.26) 100 2.790(32.05) 70 Weilite CaHAsO4
3.431(25.95) 100 3.335(26.71) 80 6.670(13.26) 60 Vlodavetsite AlCa2(SO4)2F2Cl•4(H2O)
3.440(25.88) 100 2.660(33.67) 90 2.490(36.04) 90 Nolanite (V+++,Fe++,Fe+++,Ti)10O14(OH)2
3.440(25.88) 100 3.030(29.45) 100 3.780(23.52) 90 Marialite Na4Al3Si9O24Cl
3.440(25.88) 100 2.820(31.70) 100 2.910(30.70) 100 Franckeite (Pb,Sn)6Fe++Sn2Sb2S14
3.440(25.88) 100 8.040(11.00) 100 24.100(3.66) 100 Bornemanite BaNa3{(Na,Ti)4[(Ti,Nb)2O2Si4O14](F,OH)2}•PO4
3.440(25.88) 100 3.850(23.08) 90 4.080(21.76) 50 Farringtonite Mg3(PO4)2
3.440(25.88) 100 3.380(26.35) 90 4.130(21.50) 60 Sorbyite Pb19(Sb,As)20S49
3.440(25.88) 100 3.120(28.59) 40 2.520(35.60) 35 Szomolnokite Fe++SO4•(H2O)
3.440(25.88) 100 2.810(31.82) 30 3.370(26.43) 25 Cosalite Pb2Bi2S5
3.440(25.88) 100 2.677(33.45) 95 2.753(32.50) 75 Bismoclite BiOCl
3.440(25.88) 100 2.570(34.88) 80 3.150(28.31) 80 Jinshajiangite Na2K5BaCa(Fe,Mn)8(Ti,Fe,Nb,Zr)4Si8O32(O,F,H2O)6
3.440(25.88) 100 2.560(35.02) 80 4.520(19.62) 70 Xenotime-(Yb) YbPO4
3.440(25.88) 100 2.490(36.04) 90 2.660(33.67) 90 Nolanite (V+++,Fe++,Fe+++,Ti)10O14(OH)2
3.440(25.88) 100 3.150(28.31) 80 2.570(34.88) 80 Jinshajiangite Na2K5BaCa(Fe,Mn)8(Ti,Fe,Nb,Zr)4Si8O32(O,F,H2O)6
3.440(25.88) 100 24.100(3.66) 100 8.040(11.00) 100 Bornemanite BaNa3{(Na,Ti)4[(Ti,Nb)2O2Si4O14](F,OH)2}•PO4
3.441(25.87) 100 3.428(25.97) 100 3.206(27.80) 80 Chervetite Pb2V2O7
3.441(25.87) 100 4.020(22.09) 100 3.507(25.38) 100 Nalipoite NaLi2PO4
3.441(25.87) 100 1.870(48.65) 25 4.442(19.97) 13 Virgilite LixAlxSi3-xO6
3.441(25.87) 100 3.507(25.38) 100 4.020(22.09) 100 Nalipoite NaLi2PO4
3.442(25.86) 100 3.101(28.77) 97 2.120(42.61) 80 Barite BaSO4
3.442(25.86) 100 4.060(21.87) 31 4.360(20.35) 20 Alarsite AlAsO4
3.444(25.85) 100 3.505(25.39) 52 2.390(37.60) 49 Mereiterite K2Fe++(SO4)2•4(H2O)
3.445(25.84) 100 4.360(20.35) 19 2.362(38.07) 14 Rodolicoite Fe+++PO4
3.445(25.84) 100 2.222(40.57) 80 3.653(24.35) 70 Yaroslavite Ca3Al2F10(OH)2•(H2O)
3.445(25.84) 100 1.867(48.73) 100 1.970(46.03) 90 Calciborite CaB2O4
3.450(25.80) 100 5.450(16.25) 90 3.060(29.16) 80 Teineite CuTeO3•2(H2O)
3.450(25.80) 100 2.750(32.53) 100 3.000(29.76) 70 Marrite PbAgAsS3
3.450(25.80) 100 1.768(51.66) 50 2.560(35.02) 50 Xenotime-(Y) YPO4
3.450(25.80) 100 1.961(46.26) 50 3.030(29.45) 40 Galenobismutite PbBi2S4
3.450(25.80) 100 5.560(15.93) 83 11.290(7.82) 63 Chloromenite Cu9O2(SeO3)4Cl6

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