# TITLE *Indium-In-[I4/MMM] Swanson, H.E.;Fuyat, R.K.[1954] [irritant] # CELL 3.251000 3.251000 4.945000 90.000000 90.000000 90.000000 # SPCGRP I 4/M M M TETRAGONAL STRUCTURE # ATOM IN 1 0.000000 0.000000 0.000000 # SCATTERING FACTOR COEFFICIENTS: IN F= 0.407 CM-12 # Reference: Zeitschrift fuer Anorganische und Allgemeine Chemie (1956) 286, 118-135 # # Physical parameters: # sigma_coh 2.08 coherent scattering cross section (single atom) in [barn] # sigma_inc 0.54 incoherent scattering cross section (single atom) in [barn] # sigma_abs 193.8 absorption scattering cross section (single atom) in [barn] # density 7.31 in [g/cm^3] # weight 114.8 in [g/mol] (single atom) # multiplicity 2 in [atom/unit cell] # Vc 52.26 volume of unit cell in [A^3] # v_sound 1215 in [m/s] # T_m 429.75 melting temperature in [K] # T_b 2345 boiling temperature in [K] # At_number 49 atomic number Z # lattice_a 3.251 lattice parameter a in [Angs] # lattice_c 4.945 lattice parameter c in [Angs] # # Format parameters: Crystallographica format # column_j 4 multiplicity 'j' # column_d 5 d-spacing 'd' in [Angs] # column_F2 7 norm of scattering factor |F|^2 in [fm^2] # column_h 1 # column_k 2 # column_l 3 # # h k l Mult. d-space 2Theta F-squared 1 0 1 8 2.71652 35.1383 50.5928 0 0 2 2 2.4725 38.7377 47.866 1 1 0 4 2.2988 41.7962 45.5025 1 1 2 8 1.68356 58.2955 32.9462 2 0 0 4 1.6255 60.591 31.3194 1 0 3 8 1.47016 67.8024 26.5234 2 1 1 16 1.39485 72.0128 23.9687 2 0 2 8 1.35826 74.2727 22.6769 0 0 4 2 1.23625 83.1035 18.1692 2 2 0 4 1.1494 91.0268 14.8378 2 1 3 16 1.09035 97.5365 12.5656 1 1 4 8 1.08879 97.7242 12.5059 3 0 1 8 1.05855 101.546 11.3553 2 2 2 8 1.04228 103.763 10.7433 3 1 0 8 1.02806 105.807 10.2128 2 0 4 8 0.984002 112.885 8.60781 3 1 2 16 0.949268 119.497 7.39463 1 0 5 8 0.946186 120.14 7.28967 3 0 3 8 0.905506 129.801 5.95305 3 2 1 16 0.88704 135.163 5.37967 2 2 4 8 0.84178 153.876 4.07801 0 0 6 2 0.824167 168.472 3.61565 2 1 5 16 0.817738 -1 3.45353 4 0 0 4 0.81275 -1 3.33028 3 2 3 16 0.791048 -1 2.8203 3 1 4 16 0.790451 -1 2.80689 4 1 1 16 0.778647 -1 2.54866 1 1 6 8 0.775813 -1 2.48865 4 0 2 8 0.772105 -1 2.41129 3 3 0 4 0.766268 -1 2.29223 2 0 6 8 0.73508 -1 1.71294 3 3 2 8 0.731924 -1 1.65969 3 0 5 8 0.730508 -1 1.63614 4 2 0 8 0.726946 -1 1.57774 4 1 3 16 0.711293 -1 1.33614 4 2 2 16 0.697426 -1 1.14237 4 0 4 8 0.67913 -1 0.915292 2 2 6 8 0.669779 -1 0.811517 3 2 5 16 0.666314 -1 0.775131 3 3 4 8 0.651302 -1 0.629995 5 0 1 8 0.644651 -1 0.572036 4 3 1 16 0.644651 -1 0.572036 3 1 6 16 0.64304 -1 0.558567 5 1 0 8 0.637574 -1 0.514481 4 2 4 16 0.626637 -1 0.433626 5 1 2 16 0.617378 -1 0.372511 4 1 5 16 0.616527 -1 0.367224 5 0 3 8 0.604844 -1 0.299891 4 3 3 16 0.604844 -1 0.299891 5 2 1 16 0.599246 -1 0.271006 4 0 6 8 0.578695 -1 0.182141 4 4 0 4 0.574701 -1 0.167766 5 2 3 16 0.566872 -1 0.142075 5 1 4 16 0.566653 -1 0.1414 3 3 6 8 0.561187 -1 0.125368 4 4 2 8 0.559778 -1 0.121471 5 3 0 8 0.557542 -1 0.115473 4 2 6 16 0.545177 -1 0.0862908 5 3 2 16 0.543885 -1 0.0836086 5 0 5 8 0.543304 -1 0.0824218 4 3 5 16 0.543304 -1 0.0824218 6 0 0 4 0.541833 -1 0.0794801 6 1 1 16 0.531367 -1 0.0608262 6 0 2 8 0.529273 -1 0.0575478 4 4 4 8 0.521142 -1 0.0461087 5 2 5 16 0.515283 -1 0.0390479 6 2 0 8 0.514028 -1 0.0376543 6 1 3 16 0.508404 -1 0.0318882 5 3 4 16 0.508245 -1 0.0317366 5 4 1 16 0.505066 -1 0.0288168 5 1 6 16 0.50429 -1 0.0281383 6 2 2 16 0.503267 -1 0.0272637 6 0 4 8 0.496261 -1 0.0218443 5 4 3 16 0.485224 -1 0.0151073 6 3 1 16 0.48232 -1 0.0136522 6 2 4 16 0.474634 -1 0.0103489 4 4 6 8 0.471408 -1 0.00917554 6 1 5 16 0.470195 -1 0.00876414 6 3 3 16 0.464951 -1 0.00715718 5 3 6 16 0.461798 -1 0.00631552 5 5 0 4 0.459761 -1 0.00581706 6 0 6 8 0.452753 -1 0.00434697 5 5 2 8 0.452013 -1 0.00421186 5 4 5 16 0.451678 -1 0.00415207 6 4 0 8 0.450833 -1 0.00400388 6 4 2 16 0.44352 -1 0.00289902 6 2 6 16 0.436151 -1 0.00205941 6 3 5 16 0.43519 -1 0.00196707 5 5 4 8 0.430925 -1 0.00159876 6 4 4 16 0.423548 -1 0.00110043 6 5 1 16 0.414781 -1 0.00068774 6 5 3 16 0.403579 -1 0.000360549 5 5 6 8 0.401512 -1 0.00031815 6 4 6 16 0.395524 -1 0.000218983 6 5 5 16 0.383653 -1 9.90932e-005 6 6 0 4 0.383134 -1 9.55564e-005 6 6 2 8 0.378615 -1 6.91879e-005 6 6 4 8 0.365962 -1 2.62627e-005 6 6 6 8 0.347428 -1 5.22623e-006