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XRD

The document contains a series of problems and solutions related to crystallography, specifically focusing on Miller indices, interplanar spacing, and Bragg's law. It includes calculations for various crystal structures such as cubic, tetragonal, and body-centered cubic (BCC), using X-ray diffraction data. The final problem identifies the structure and lattice parameter of a material based on X-ray diffraction patterns, concluding that the material is likely copper with a lattice parameter of 3.62 A.

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0% found this document useful (0 votes)
60 views9 pages

XRD

The document contains a series of problems and solutions related to crystallography, specifically focusing on Miller indices, interplanar spacing, and Bragg's law. It includes calculations for various crystal structures such as cubic, tetragonal, and body-centered cubic (BCC), using X-ray diffraction data. The final problem identifies the structure and lattice parameter of a material based on X-ray diffraction patterns, concluding that the material is likely copper with a lattice parameter of 3.62 A.

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Krishna
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Materials s ene: UNEF Problem 1: A plane makes intercepts along, thr indices axes a band cas 3,2, 1. Pind the miller Solution: Interwepts 30201 Reciprocal Won oa Smallest integer 68 62 oll 23 6 Miller indices (236) Problem 2: Fisd the Miller indices of a plane that makes intercepts on the a, by € axes equal to 3 A. 4 A and 3 A respectively in a tetragonal crystal with c/a ratio of 1.5.(For tetragonal erystal a = bee anda=B=y) [GU 2010} Solution: For tetragonal crystal a=b#e Given cla > c=la Let asl therefore b = 1 and ¢ = 15 B43 Intercepts are Bo eS = i as Reciprocal Miller Indices (4. 3 6) Materials Selene INIT Problem 1: A plane makes intercepts along three axes a band ¢ 96 3.2.1, Find the miller Intercepts 302041 Recipnoeal wow om Smallest integer 63 62 on 23 6 Miller indices (236) risblem 2: the Miller indices ofa plane that makes intercepts on the a, b, ¢ axes equal to 3 4 Aand 3 A respectively in a tetragonal erystal with e/a ratio of 1.5.(For tetragonal erystal a= bee anda=B=y) [GU 2010] Solution: For tetragonal crystal a=b#e Given ca => cla Let ael therefore 6 = 1 and ¢ = 15 Intercepts are Reciprocal Miller Indices (4. 3 6) Problem 3: Determine the interplanar spacing when a beam of X-ray of wavelength1.54 A is directed towards the erystal at angle 20,3" to the atomic plane. Solution: Given, X= 154A and 0=20.3° Assuming the first order reflection. We know that as per Bragg’s law, 2dsinO=nd 2d sin 20.3° = 1x1.54 1.34 1s4 Fein 203 05365 22.4 Problem 4: A XRD pattern of a cubic crystal of lattice parameter a = 3.16 A is obtained with a ‘monochromatic X-ray beam of wavelength 1.54 A. The first four lines on this pattern were observed to have the following values Line 8 (in degrees ) 1 20.3 2 29.2 3 367 4 43.6 Determine the interplanar spacing and the Miller indices of the reflecting planes. Solution: Line | (in degrees)| 4. (ay a 7 203 2220 20279 =2 110 2 29.2 1379 4.0101 =4 200 - 3 36.7 1,288 6.015 =6 2 4 43.6 1.165 8.0104 =8 220 n= 2 dy sind Assume n= 1 Wake? = 2 dy = 41240? = And he (110) See? Problem S: A diffraction pattem of a cubic crystal of lattice parameter a = 3.16 A is obtained swith a monochromatic X-rays of wavelength 1.54 A, The first line on this pattern was observed 20.3°. Determine the interplanar spacing and the indices of the reflecting to have plane. Solution: 0=20.3° Given, a=3.16A . AR1S4A We know from Bragg’s Law 2d sin@ = nd > WHHL? = 2 If we assume ]= 0, h?+k? = 2. This is possible only when h = 1, k=1 similarly, if h= 0 ork = 0 we get the value of as k= 1,1= 1 and Thus Miller indices of the reflecting planes are (110), (O11) or (101) Problem 63 Calculate the Bragg angle if (111) planes of a cube (a= 3.57 A) crystal are rays ( wavelength is 1.54 A) exposed t0 } Solution: Given, Miller indices of the (111 ) planes n=1,k=1and STA AE LS4A We know, According to Bragg’s law, 2diosinB=n2 22,06 sin @ = 1X1.54 sir ‘oblem 7: the distance between (111) planes in a face centered cubic crystal is 2A. Determine the lattice parameter and the atomic diameter. (For FCC + ) [GU 2011C} diy = 2A. Solution: Given, h=1,k= 1,1 (i) Lattice parameter: a= 2x3 =3.46 A Gi) Atomic diameter: For FCC structure, Therefore, Atomic diameter shim 8: A FCC crystal has an atomic radius 1.246 A. What are the - divi spacing? Solutio Given, r= 1.246 A For FCC Spacing with Miller indices (h k 1) problem 11; Calculate the Bragg angle if (111) planes of a cube (a=3.57 A ) crystal are exposed to X-rays ( wavelength is 1.54 A) Solution: Given, — Miller indices of the (111) planes, h= i, k= 11>; a> 3.57 Aand d= 1.54 A, Let 6 = Bragg’s angle for first order reflection We know that for a cubic erystal system, the interplanar distance And according to Braga’s law 2diy) sin = 2x2,06x sin @= 1*1.54 sin @ = 0.373 a=210°9 tion angle for Problem 12: For BCC iron, compute (i) the interplanar spacing and (ji) the diffrac the (211) set of planes, The lattice parameter for the iran is 0.2866 nm ( 2.866 A ). Also assume the monochromatic radiation having a wavelength of 0.1542 nm ( 1.542 A ) is used and order of reflection is 1. Solution: Given, ‘The lattice parameter for iron, a = 0.2866 nm Wavelength of monochromatic radiation, 1542. nm Order of reflection, We know that Miller indices of the (211) plane, () Interplanar spacing: We know that interplanar spacing, = 0.1433 nm Gi) Diffraction angle: Let, 0 = Bragg’s angle of first order diffraction ‘We know that the condition for the maxima 2d sin =n Here d=doy and a=l 2dayy sin @ = 10.1542 sin 0 = 0.5380 @ = sin™{0,5380) = 32°54 Problem 13: From a powder eamera of diameter 114.6 mm, using an X-ray beam of wavelength 1.54 A, the following $ values in mm are obtained for a material 86, 100, 148, 180, 188,232, 272 Determine the structure and the lattice parameter of the material. [GU 2012¢ } in? sin?9 | 2 W123 WH | kd a 0.1346 1 1xa=3 3 f aw 0.1788 133 1,2 5*3=3,99 4 (200) 0.3620 27 2.7*3=8.1 8 (220) 0.5003 sn |aapaenis} i | GID | 36! | 05352] 3.97 | 3.97«3=11.92/ 12 | (222) | 0.7195 5.34 5.34x3=16.03| 16 | (409) 19 | G31) 0.8596 638 | 6.38x3=19.14 = 2d sin 8, Here, 9=68° [Lattice parameter shoul be calculated from the highest peak] > 1.54 =2dx0.93 = 4-083 _ Again, mo assed Since the ratio of integral nos. are 1:12: 16:19 ‘The structure is FCC. Corresponding to lattice parameter 3.62 A, the material is likely to be Copper.

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