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 516 Records Sorted by D1 using 1.54056 - CuKa1 for 2θ WHERE (d1 > 3.11542 AND d1 < 3.24258)
D1
Å (2θ)
I1
%)
D2
Å (2θ)
I2
(%)
D3
Å (2θ)
I3
(%)
Mineral Formula
3.116(28.62) 100 2.282(39.45) 75 4.550(19.49) 55 Vihorlatite Bi24Se17Te4
3.116(28.62) 100 4.487(19.77) 90 2.760(32.41) 90 Calcioandyrobertsite-2O KCaCu5(AsO4)4[As(OH)2O2]•2(H2O)
3.116(28.62) 100 6.210(14.25) 72 7.210(12.27) 70 Yegorovite Na4[Si2O4(OH)2]2•7H2O
3.116(28.62) 100 2.760(32.41) 90 4.487(19.77) 90 Calcioandyrobertsite-2O KCaCu5(AsO4)4[As(OH)2O2]•2(H2O)
3.117(28.61) 100 1.840(49.50) 80 2.722(32.88) 50 Scrutinyite PbO2
3.118(28.61) 100 1.844(49.38) 50 1.595(57.75) 45 Samaniite Cu2Fe5Ni2S8
3.118(28.61) 100 3.005(29.71) 60 1.637(56.14) 50 Petewilliamsite (Ni,Co,Cu)30(As2O7)15
3.118(28.61) 100 3.090(28.87) 95 9.400(9.40) 80 Chaidamuite (Zn,Fe++)Fe+++(SO4)2(OH)•4(H2O)
3.118(28.61) 100 1.637(56.14) 60 2.567(34.92) 50 Petewilliamsite (Ni,Co,Cu)30(As2O7)15
3.119(28.60) 100 1.560(59.18) 100 2.505(35.82) 80 Harrisonite Ca(Fe++,Mg)6(PO4)2(SiO4)2
3.119(28.60) 100 3.660(24.30) 80 2.518(35.63) 75 Phenakite Be2SiO4
3.119(28.60) 100 2.558(35.05) 100 1.560(59.18) 80 Harrisonite Ca(Fe++,Mg)6(PO4)2(SiO4)2
3.120(28.59) 100 2.840(31.47) 100 2.840(31.47) 85 Calcybeborosilite-(Y) (REE,Ca)2[ ](B,Be)2(SiO4)2(OH,O)2
3.120(28.59) 100 2.820(31.70) 100 4.010(22.15) 80 Mcbirneyite Cu3(VO4)2
3.120(28.59) 100 2.630(34.06) 100 3.620(24.57) 100 Garavellite FeSbBiS4
3.120(28.59) 100 22.000(4.01) 100 11.000(8.03) 80 Gyrolite NaCa16Si23AlO60(OH)8•64(H2O)
3.120(28.59) 100 9.100(9.71) 90 4.600(19.28) 70 Lanthanite-(La) (La,Ce)2(CO3)3•8(H2O)
3.120(28.59) 100 2.961(30.16) 100 3.546(25.09) 80 Petrovicite PbHgCu3BiSe5
3.120(28.59) 100 2.700(33.15) 100 2.670(33.54) 100 Harmotome (Ba,Na,K)1-2(Si,Al)8O16•6(H2O)
3.120(28.59) 100 8.380(10.55) 100 2.710(33.03) 90 Actinolite Ca2(Mg,Fe++)5Si8O22(OH)2
3.120(28.59) 100 1.173(82.09) 90 2.198(41.03) 70 IMA2009-015 NaSrCeF6
3.120(28.59) 100 4.360(20.35) 70 3.880(22.90) 70 Kvanefjeldite Na4(Ca,Mn)Si6O14(OH)2
3.120(28.59) 100 2.828(31.61) 80 2.253(39.98) 80 Fluorthalenite-(Y) Y3Si3O10F
3.120(28.59) 100 2.520(35.60) 70 2.670(33.54) 30 Tanteuxenite-(Y) (Y,Ce,Ca)(Ta,Nb,Ti)2(O,OH)6
3.120(28.59) 100 8.430(10.49) 80 3.267(27.27) 40 Edenite NaCa2Mg5Si7AlO22(OH)2
3.120(28.59) 100 8.380(10.55) 100 2.710(33.03) 90 Tremolite [ ]Ca2Mg5Si8O22(OH)2
3.120(28.59) 100 8.200(10.78) 75 2.798(31.96) 40 Magnesio-arfvedsonite NaNa2(Mg4Fe++)Si8O22(OH)2
3.120(28.59) 100 2.870(31.14) 70 2.520(35.60) 30 Tanteuxenite-(Y) (Y,Ce,Ca)(Ta,Nb,Ti)2(O,OH)6
3.120(28.59) 100 2.580(34.74) 50 3.970(22.38) 45 Kalsilite KAlSiO4
3.120(28.59) 100 2.310(38.96) 50 4.920(18.01) 40 Kawazulite Bi2(Te,Se,S)3
3.120(28.59) 100 2.280(39.49) 33 4.660(19.03) 19 Telluronevskite Bi3TeSe2
3.120(28.59) 100 2.253(39.98) 80 2.828(31.61) 80 Fluorthalenite-(Y) Y3Si3O10F
3.120(28.59) 100 1.915(47.44) 55 1.633(56.29) 30 Nantokite CuCl
3.120(28.59) 100 1.909(47.59) 54 1.627(56.52) 40 Aktashite Cu6Hg3As4S12
3.120(28.59) 100 1.904(47.73) 90 2.730(32.78) 80 Kalistrontite K2Sr(SO4)2
3.120(28.59) 100 1.796(50.79) 90 1.173(82.09) 70 IMA2009-015 NaSrCeF6
3.120(28.59) 100 2.955(30.22) 95 1.900(47.83) 75 Fergusonite-beta-(Y) YNbO4
3.120(28.59) 100 2.960(30.17) 90 1.901(47.81) 50 Fergusonite-(Y) YNbO4
3.120(28.59) 100 3.310(26.91) 85 2.150(41.99) 40 Monazite-(La) (La,Ce,Nd)PO4
3.120(28.59) 100 3.880(22.90) 70 4.360(20.35) 70 Kvanefjeldite Na4(Ca,Mn)Si6O14(OH)2
3.120(28.59) 100 6.460(13.70) 73 5.950(14.88) 70 Georgechaoite KNaZrSi3O9•2(H2O)
3.120(28.59) 100 5.930(14.93) 60 2.580(34.74) 50 Rhodostannite Cu2FeSn3S8
3.122(28.57) 100 7.120(12.42) 80 3.550(25.06) 60 Richetite PbU++++++4O13•4(H2O)
3.122(28.57) 100 8.399(10.52) 56 2.798(31.96) 48 Leakeite NaNa2(Mg2Fe+++2Li)Si8O22(OH)2
3.123(28.56) 100 1.912(47.51) 51 1.633(56.29) 30 Sphalerite (Zn,Fe)S
3.123(28.56) 100 2.162(41.74) 40 2.804(31.89) 30 Paulkellerite Bi2Fe+++(PO4)O2(OH)2
3.123(28.56) 100 3.723(23.88) 100 2.641(33.91) 80 Magnesiochlorophoenicite (Mg,Mn)3Zn2(AsO4)(OH,O)6
3.124(28.55) 100 3.271(27.24) 61 8.421(10.50) 61 Fluoro-magnesiohastingsite (Na,K)Ca2(Mg,Fe+++,Ti)5(Si,Al)8O22F2
3.124(28.55) 100 5.930(14.93) 80 5.840(15.16) 80 Gaidonnayite Na2ZrSi3O9•2(H2O)
3.124(28.55) 100 8.430(10.49) 40 3.269(27.26) 35 Pargasite NaCa2(Mg,Fe++)4Al(Si6Al2)O22(OH)2
3.124(28.55) 100 1.913(47.49) 51 1.632(56.33) 44 Cerianite-(Ce) (Ce++++,Th)O2
3.124(28.55) 100 8.421(10.50) 61 3.271(27.24) 61 Fluoro-magnesiohastingsite (Na,K)Ca2(Mg,Fe+++,Ti)5(Si,Al)8O22F2
3.124(28.55) 100 5.840(15.16) 80 5.930(14.93) 80 Gaidonnayite Na2ZrSi3O9•2(H2O)
3.125(28.54) 100 8.403(10.52) 60 3.271(27.24) 50 Fluoro-edenite NaCa2Mg5Si7AlO22(F,OH)2
3.125(28.54) 100 3.140(28.40) 90 4.018(22.10) 40 Barytocalcite BaCa(CO3)2
3.128(28.51) 100 3.071(29.05) 70 3.596(24.74) 70 Kupcikite Cu3.4Fe0.6Bi5S10
3.128(28.51) 100 1.918(47.36) 50 1.637(56.14) 30 Geerite Cu8S5
3.128(28.51) 100 3.596(24.74) 70 3.071(29.05) 70 Kupcikite Cu3.4Fe0.6Bi5S10
3.128(28.51) 100 7.080(12.49) 100 3.485(25.54) 80 Agrinierite (K2,Ca,Sr)U3O10•4(H2O)
3.129(28.50) 100 8.420(10.50) 34 2.804(31.89) 28 Fluoro-magnesio-arfvedsonite NaNa2(Mg,Fe++)4Fe+++[Si8O22](F,OH)2
3.130(28.49) 100 1.110(87.89) 60 1.915(47.44) 60 Petrukite (Cu,Fe,Zn)2(Sn,In)S4
3.130(28.49) 100 1.915(47.44) 60 1.110(87.89) 60 Petrukite (Cu,Fe,Zn)2(Sn,In)S4
3.130(28.49) 100 6.220(14.23) 80 2.660(33.67) 80 Glauberite Na2Ca(SO4)2
3.130(28.49) 100 3.550(25.06) 60 2.960(30.17) 60 Stibiotantalite SbTaO4
3.130(28.49) 100 5.640(15.70) 50 3.850(23.08) 50 Colemanite Ca2B6O11•5(H2O)
3.130(28.49) 100 8.540(10.35) 80 8.450(10.46) 80 Cordierite Mg2Al4Si5O18
3.130(28.49) 100 1.915(47.44) 60 1.106(88.29) 60 Petrukite (Cu,Fe,Zn)2(Sn,In)S4
3.130(28.49) 100 3.110(28.68) 100 2.930(30.48) 45 Thortveitite (Sc,Y)2Si2O7
3.130(28.49) 100 2.850(31.36) 100 2.572(34.85) 80 Hingganite-(Yb) (Yb,Y)2([ ])Be2Si2O8(OH)2
3.130(28.49) 100 2.660(33.67) 80 6.220(14.23) 80 Glauberite Na2Ca(SO4)2
3.130(28.49) 100 2.830(31.59) 100 2.560(35.02) 90 Gadolinite-(Y) Y2Fe++Be2Si2O10
3.130(28.49) 100 1.570(58.76) 90 1.640(56.03) 70 Formanite-(Y) YTaO4
3.130(28.49) 100 1.822(50.02) 80 3.250(27.42) 80 Phyllotungstite CaFe+++3H(WO4)6•10(H2O)
3.130(28.49) 100 1.914(47.46) 80 1.640(56.03) 60 Kuramite Cu3SnS4
3.130(28.49) 100 1.919(47.33) 50 1.110(87.89) 40 Ferrokesterite Cu2(Fe,Zn)SnS4
3.130(28.49) 100 8.450(10.46) 80 8.540(10.35) 80 Cordierite Mg2Al4Si5O18
3.130(28.49) 100 6.260(14.14) 100 10.290(8.59) 90 Benyacarite (H2O,K)2Ti(Mn++,Fe++)2(Fe+++,Ti)2Ti(PO4)4(O,F)2•14(H2O)
3.130(28.49) 100 3.850(23.08) 50 5.640(15.70) 50 Colemanite Ca2B6O11•5(H2O)
3.130(28.49) 100 3.299(27.01) 100 6.589(13.43) 75 Montesommaite (K,Na)9Al9Si23O64•10(H2O)
3.130(28.49) 100 2.960(30.17) 60 3.550(25.06) 60 Stibiotantalite SbTaO4
3.130(28.49) 100 2.950(30.27) 94 1.862(48.87) 29 Iwashiroite-(Y) YTaO4
3.130(28.49) 100 2.947(30.30) 30 1.735(52.71) 20 Stibiocolumbite SbNbO4
3.130(28.49) 100 2.930(30.48) 90 1.570(58.76) 70 Formanite-(Y) YTaO4
3.130(28.49) 100 2.880(31.03) 60 3.640(24.43) 50 Alumotantite AlTaO4
3.130(28.49) 100 1.919(47.33) 50 1.634(56.25) 40 Rudashevskyite (Fe,Zn)S
3.130(28.49) 100 1.920(47.30) 70 2.720(32.90) 20 Mohite Cu2SnS3
3.130(28.49) 100 1.862(48.87) 94 1.890(48.10) 29 Iwashiroite-(Y) YTaO4
3.130(28.49) 100 3.250(27.42) 80 1.822(50.02) 80 Phyllotungstite CaFe+++3H(WO4)6•10(H2O)
3.131(28.48) 100 6.220(14.23) 80 3.892(22.83) 80 Klebelsbergite Sb+++4O4(OH)2(SO4)
3.131(28.48) 100 3.892(22.83) 80 6.220(14.23) 80 Klebelsbergite Sb+++4O4(OH)2(SO4)
3.132(28.47) 100 2.812(31.80) 100 3.257(27.36) 100 Kornite Na(CaNa)Fe++4(Al,Fe+++)Si7AlO22(OH)2
3.132(28.47) 100 2.329(38.63) 40 3.713(23.95) 30 Dussertite BaFe+++3(AsO4)2(OH)5
3.132(28.47) 100 3.189(27.96) 100 2.058(43.96) 80 Schlemaite (Cu,[ ])6(Pb,Bi)Se4
3.133(28.47) 100 3.163(28.19) 76 1.685(54.41) 49 Leiteite ZnAs+++2O4
3.134(28.46) 100 1.917(47.38) 50 1.644(55.88) 10 Silicon Si
3.134(28.46) 100 2.818(31.73) 80 1.887(48.18) 65 Idaite Cu5FeS6
3.134(28.46) 100 1.915(47.44) 30 1.929(47.07) 25 Stannite Cu2FeSnS4
3.134(28.46) 100 2.788(32.08) 80 2.506(35.80) 60 Stranskiite Zn2Cu++(AsO4)2
3.135(28.45) 100 2.868(31.16) 45 3.433(25.93) 35 Hydroxylherderite CaBe(PO4)(OH)
3.135(28.45) 100 2.866(31.18) 70 3.720(23.90) 60 Anapaite Ca2Fe++(PO4)2•4(H2O)

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