Mineralogy Database

X-Ray Diffraction Table

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Minerals Arranged by X-Ray Powder Diffraction

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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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Found 4479 Records, Sorted by D1 using 1.54056 - CuKa1 for 2θ
D1
Å (2θ)
I1
%)
D2
Å (2θ)
I2
(%)
D3
Å (2θ)
I3
(%)
Mineral Formula
5.120(17.31) 200 14.200(6.22) 180 7.096(12.46) 120 Cronstedtite Fe++2Fe+++(SiFe+++)O5(OH)4
5.120(17.31) 200 5.720(15.48) 170 7.220(12.25) 170 Tephroite Mn2SiO4
5.120(17.31) 200 14.320(6.17) 140 5.776(15.33) 120 Mcgillite (Mn,Fe++)8Si6O15(OH)8Cl2
5.120(17.31) 200 14.340(6.16) 180 7.200(12.28) 140 Friedelite Mn8Si6O15(OH,Cl)10
5.120(17.31) 200 3.824(23.24) 160 2.820(31.70) 140 Gudmundite FeSbS
5.120(17.31) 200 4.440(19.98) 180 3.148(28.33) 160 Niobocarbide (Nb,Ta)C
5.120(17.31) 200 6.420(13.78) 140 4.220(21.03) 140 Clintonite Ca(Mg,Al)3(Al3Si)O10(OH)2
5.120(17.31) 200 3.054(29.22) 140 3.324(26.80) 120 Filipstadite (Mn++,Mg)4Sb+++++Fe+++O8
5.124(17.29) 200 3.354(26.55) 182 6.276(14.10) 148 IMA2009-033 Ca3Sn2Fe2SiO12
5.124(17.29) 200 9.920(8.91) 140 11.040(8.00) 140 Shortite Na2Ca2(CO3)3
5.126(17.29) 200 3.006(29.70) 80 6.010(14.73) 70 Jacobsite (Mn++,Fe++,Mg)(Fe+++,Mn+++)2O4
5.134(17.26) 200 7.938(11.14) 200 8.422(10.50) 180 Magnesiofoitite [ ](Mg2Al)Al6(Si6O18)(BO3)3(OH)4
5.138(17.24) 200 3.080(28.97) 100 5.746(15.41) 80 Almandine Fe++3Al2(SiO4)3
5.140(17.24) 200 8.352(10.58) 76 5.914(14.97) 60 Yuanfuliite (Mg,Fe++)(Fe+++,Al,Mg,Ti,Fe++)(BO3)O
5.140(17.24) 200 10.140(8.71) 160 4.320(20.54) 120 Azoproite (Mg,Fe++)2(Fe+++,Ti,Mg)BO5
5.140(17.24) 200 3.012(29.63) 80 6.032(14.67) 80 Iwakiite Mn++(Fe+++,Mn+++)2O4
5.142(17.23) 200 5.204(17.02) 190 3.008(29.67) 182 Ganterite [Ba0.5(Na,K)0.5]Al2(Si2.5Al1.5O10)(OH)2
5.142(17.23) 200 14.240(6.20) 160 7.118(12.42) 160 Greenalite (Fe++,Fe+++)2-3Si2O5(OH)4
5.146(17.22) 200 6.904(12.81) 182 12.676(6.97) 168 Foitite [ ]Na<0.5(Fe++,Al)3Al6Si6O18(BO3)3(OH)4
5.148(17.21) 200 3.018(29.57) 90 3.286(27.11) 70 Ulvospinel TiFe++2O4
5.148(17.21) 200 5.822(15.21) 140 8.420(10.50) 120 Ardennite-(As) (Mn++,Ca,Mg)4(Al,Mg,Fe)6(SiO4)2(Si3O10)(AsO4,VO4)(OH)6
5.148(17.21) 200 5.458(16.23) 180 5.414(16.36) 160 Maricite NaFe++PO4
5.150(17.20) 200 10.300(8.58) 60 3.072(29.04) 34 Vonsenite Fe++2Fe+++BO5
5.150(17.20) 200 9.100(9.71) 160 6.700(13.20) 120 Voloshinite Rb(LiAl1.5[ ]0.5)(Al0.5Si3.5)O10F2
5.152(17.20) 200 5.922(14.95) 170 7.980(11.08) 170 Schorl NaFe++3Al6(BO3)3Si6O18(OH)4
5.152(17.20) 200 5.922(14.95) 170 7.980(11.08) 170 Dravite NaMg3Al6(BO3)3Si6O18(OH)4
5.152(17.20) 200 5.922(14.95) 170 7.980(11.08) 170 Elbaite Na(Li,Al)3Al6(BO3)3Si6O18(OH)4
5.156(17.18) 200 5.372(16.49) 200 2.870(31.14) 180 Fluorocannilloite CaCa2(Mg4Al)Si5Al3O22F2
5.158(17.18) 200 5.114(17.33) 180 9.238(9.57) 80 Nullaginite Ni2(CO3)(OH)2
5.160(17.17) 200 7.300(12.11) 180 6.220(14.23) 102 Kenhsuite Hg3S2Cl2
5.160(17.17) 200 4.216(21.05) 112 10.320(8.56) 44 Sakhaite Ca3Mg(BO3)2(CO3)·0.36(H2O)
5.160(17.17) 200 9.060(9.75) 170 7.280(12.15) 160 Celadonite K(Mg,Fe++)(Fe+++,Al)[Si4O10](OH)2
5.160(17.17) 200 3.000(29.76) 100 3.200(27.86) 100 Warwickite Mg(Ti,Fe+++,Al)(BO3)O
5.160(17.17) 200 5.920(14.95) 170 7.980(11.08) 170 Buergerite NaFe+++3Al6(BO3)3Si6O21F
5.162(17.16) 200 3.640(24.43) 140 7.320(12.08) 100 Koashvite Na6(Ca,Mn)(Ti,Fe)Si6O18·(H2O)
5.164(17.16) 200 8.360(10.57) 180 5.062(17.51) 140 Olympite LiNa5(PO4)2
5.168(17.14) 200 11.116(7.95) 172 6.140(14.41) 146 Mozartite CaMn+++SiO4(OH)
5.168(17.14) 200 5.002(17.72) 180 5.854(15.12) 180 Namansilite NaMn+++(Si2O6)
5.170(17.14) 200 5.970(14.83) 160 3.656(24.33) 120 Keilite (Fe,Mn,Mg,Ca,Cr)S
5.170(17.14) 200 4.460(19.89) 180 8.980(9.84) 180 Niksergievite [Ba,Ca)2(Al,Si)7O10(CO3)(OH)6·nH2O
5.172(17.13) 200 5.958(14.86) 160 8.480(10.42) 120 Feruvite (Ca,Na)(Fe,Mg,Ti)3(Al,Mg,Fe)6(BO3)3Si6O18(OH)4
5.174(17.12) 200 7.360(12.01) 140 5.032(17.61) 80 Glaukosphaerite (Cu,Ni)2(CO3)(OH)2
5.176(17.12) 200 9.080(9.73) 186 4.818(18.40) 174 Chromceladonite KCrMg(Si4O10)(OH)2
5.176(17.12) 200 4.728(18.75) 160 3.092(28.85) 120 Dzharkenite FeSe2
5.178(17.11) 200 5.218(16.98) 140 6.012(14.72) 140 Remondite-(Ce) Na3(Ce,La,Ca,Na,Sr)3(CO3)5
5.180(17.10) 200 4.280(20.74) 180 5.420(16.34) 180 Penzhinite (Ag,Cu)4Au(S,Se)4
5.180(17.10) 200 4.980(17.80) 170 3.780(23.52) 160 Ferroselite FeSe2
5.180(17.10) 200 6.580(13.45) 200 6.000(14.75) 160 Crookesite Cu7(Tl,Ag)Se4
5.180(17.10) 200 7.840(11.28) 200 6.040(14.65) 140 Fedorovskite Ca2(Mg,Mn)2B4O7(OH)6
5.180(17.10) 200 9.580(9.22) 200 19.080(4.63) 200 Chalcophyllite Cu++18Al2(AsO4)3(SO4)3(OH)27·33(H2O)
5.180(17.10) 200 4.972(17.82) 180 10.320(8.56) 160 Fredrikssonite Mg2(Mn+++,Fe+++)O2(BO3)
5.184(17.09) 200 3.670(24.23) 70 4.386(20.23) 70 Skutterudite (Co,Ni)As3-x
5.186(17.08) 200 3.492(25.49) 160 4.730(18.74) 160 Krutovite NiAs2
5.192(17.06) 200 5.006(17.70) 180 3.816(23.29) 160 Costibite CoSbS
5.192(17.06) 200 5.062(17.51) 170 10.384(8.51) 130 Orthopinakiolite (Mg,Mn++)2Mn+++BO5
5.192(17.06) 200 4.242(20.92) 180 6.080(14.56) 160 Buryatite Ca3(Si,Fe+++,Al)[SO4][B(OH)4](OH,O)6·12(H2O)
5.192(17.06) 200 6.362(13.91) 144 3.876(22.93) 128 Seifertite SiO2
5.196(17.05) 200 5.782(15.31) 140 8.674(10.19) 120 Frankhawthorneite Cu2Te++++++O4(OH)2
5.196(17.05) 200 8.342(10.60) 140 6.698(13.21) 120 Chantalite CaAl2SiO4(OH)4
5.196(17.05) 200 5.732(15.45) 180 10.720(8.24) 160 Nabaphite NaBaPO4·9(H2O)
5.196(17.05) 200 18.652(4.73) 170 6.836(12.94) 160 Gerstmannite (Mg,Mn)2ZnSiO4(OH)2
5.200(17.04) 200 4.340(20.45) 180 12.200(7.24) 140 Pokrovskite Mg2(CO3)(OH)2·0.5(H2O)
5.200(17.04) 200 4.886(18.14) 120 14.580(6.06) 100 Dioptase CuSiO2(OH)2
5.200(17.04) 200 3.632(24.49) 160 5.040(17.58) 160 Kazakovite Na6Mn++TiSi6O18
5.200(17.04) 200 3.820(23.27) 160 4.140(21.45) 160 Caswellsilverite NaCrS2
5.200(17.04) 200 6.180(14.32) 100 7.600(11.63) 60 Tachyhydrite CaMg2Cl6·12(H2O)
5.200(17.04) 200 3.120(28.59) 80 3.220(27.68) 60 Spessartine Mn++3Al2(SiO4)3
5.202(17.03) 200 3.678(24.18) 120 3.002(29.74) 32 Niningerite (Mg,Fe++,Mn)S
5.202(17.03) 200 4.260(20.83) 120 6.020(14.70) 100 Calcioburbankite Na3(Ca,REE,Sr)3(CO3)5
5.204(17.02) 200 3.514(25.32) 160 4.756(18.64) 160 Jolliffeite (Ni,Co)AsSe
5.204(17.02) 200 4.938(17.95) 50 5.462(16.21) 50 Eitelite Na2Mg(CO3)2
5.206(17.02) 200 8.256(10.71) 160 7.422(11.91) 130 Wycheproofite NaAlZr(PO4)2(OH)2·(H2O)
5.208(17.01) 200 3.976(22.34) 100 4.166(21.31) 50 Westerveldite (Fe,Ni,Co)As
5.209(17.01) 200 10.486(8.43) 90 4.544(19.52) 80 Blatterite (Mn++,Mg)35Sb3(Mn+++,Fe+++)9(BO3)16O32
5.212(17.00) 200 4.880(18.16) 160 4.766(18.60) 150 Acanthite Ag2S
5.212(17.00) 200 5.912(14.97) 162 5.918(14.96) 144 Sibirskite CaHBO3
5.212(17.00) 200 4.140(21.45) 140 7.016(12.61) 120 Mckinstryite (Ag,Cu)2S
5.214(16.99) 200 10.440(8.46) 100 7.400(11.95) 80 Petersenite-(Ce) (Na,Ca)4(Ce,La,Nd)2(CO3)5
5.216(16.98) 200 6.104(14.50) 66 3.330(26.75) 60 Tegengrenite (Mg,Mn++)2Sb+++++0.5(Mn+++,Si,Ti)0.5O4
5.216(16.98) 200 3.030(29.45) 160 2.622(34.17) 50 Lourenswalsite (K,Ba)2(Ti,Mg,Ca,Fe)4(Si,Al,Fe)6O14(OH)12
5.218(16.98) 200 5.896(15.01) 180 3.170(28.13) 150 Ardennite-(V) Mn++4[Al4(Mg,Al,Fe+++,Mn+++)2][Si5(V,Si)]O22(OH)6
5.220(16.97) 200 3.680(24.16) 180 4.260(20.83) 160 Harkerite Ca24Mg8Al2(SiO4)8(BO3)6(CO3)10·2(H2O)
5.220(16.97) 200 6.280(14.09) 80 4.220(21.03) 60 Chlorocalcite KCaCl3
5.220(16.97) 200 5.560(15.93) 200 7.560(11.70) 200 Hanksite KNa22(SO4)9(CO3)2Cl
5.220(16.97) 200 6.500(13.61) 200 8.160(10.83) 200 Thorosteenstrupine (Ca,Th,Mn)3Si4O11F·6(H2O)
5.220(16.97) 200 5.760(15.37) 200 8.300(10.65) 150 Tangeite CaCu(VO4)(OH)
5.220(16.97) 200 6.020(14.70) 120 3.174(28.09) 100 Lavrentievite Hg3S2(Cl,Br)2
5.220(16.97) 200 3.232(27.58) 180 3.682(24.15) 180 Nickelskutterudite (Ni,Co)As3-x
5.220(16.97) 200 4.140(21.45) 160 6.660(13.28) 160 Stromeyerite AgCuS
5.220(16.97) 200 4.660(19.03) 180 3.276(27.20) 160 Lollingite FeAs2
5.224(16.96) 200 3.694(24.07) 100 3.018(29.57) 40 Alabandite MnS
5.226(16.95) 200 11.410(7.74) 200 6.096(14.52) 180 Potassiccarpholite (K,Na,[ ])(Li,Mn++)2Al)4Si4O12(OH)4(F,OH)4
5.228(16.95) 200 5.680(15.59) 180 8.040(11.00) 160 Aminoffite Ca3Be2Si3O10(OH)2
5.232(16.93) 200 5.530(16.01) 170 4.828(18.36) 98 Hawthorneite Ba[Ti3Cr4Fe4Mg]O19
5.232(16.93) 200 3.272(27.23) 130 7.018(12.60) 122 Akimotoite (Mg,Fe)SiO3
5.238(16.91) 200 8.520(10.37) 160 6.720(13.16) 140 Plumbonacrite Pb10(CO3)6O(OH)6
5.240(16.91) 200 19.460(4.54) 160 6.520(13.57) 80 Aspidolite NaMg3AlSi3O10(OH)2
5.240(16.91) 200 6.080(14.56) 150 7.160(12.35) 150 Chromdravite NaMg3(Cr,Fe+++)6(BO3)3Si6O18(OH)4
5.240(16.91) 200 4.140(21.45) 180 6.080(14.56) 180 Vanadiumdravite NaMg3V6(Si6O18)(BO3)3(OH)4
5.240(16.91) 200 6.060(14.61) 120 4.780(18.55) 80 Coparsite Cu4O2[(As,V)O4]Cl

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