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# TITLE *Aluminum-Al-[FM3-M] Miller, H.P.jr.;DuMond, J.W.M.[1942] at 298 K
# CELL 4.049320 4.049320 4.049320 90.000000 90.000000 90.000000
# SPCGRP F M 3 M   CUBIC STRUCTURE
# ATOM AL 1 0.000000 0.000000 0.000000
# SCATTERING FACTOR  COEFFICIENTS: AL     F= 0.345 CM-12
# Reference: Physical Review (1940) 57, 198-206
#
# Physical parameters:
# sigma_coh 1.495   coherent scattering cross section (single atom) in [barn]
# sigma_inc 0.0082  incoherent scattering cross section (single atom)in [barn]
# sigma_abs 0.231   absorption scattering cross section (single atom) in [barn]
# density   2.70    in [g/cm^3]
# weight    26.98   in [g/mol] (single atom)
# multiplicity  4   in [atoms/unit cell]
# Vc        66.4    volume of unit cell in [A^3]
# v_sound   5100    in [m/s]
# v_sound_l 6420    velocity of longitudinal sound in [m/s]
# v_sound_t 3040    velocity of transversal sound in [m/s]
# T_m       933.5   melting temperature in [K]
# T_b       2792.2  boiling temperature in [K]
# At_number 13      atomic number Z
# lattice_a 4.04932 lattice parameter a in [Angs]
#
# Format parameters: Lazy format <http://icsd.ill.fr>
# column_j 17 multiplicity 'j'
# column_d 6  d-spacing 'd' in [Angs]
# column_F 13 norm of scattering factor |F| in [barn^0.5]
# column_h 1
# column_k 2
# column_l 3
#
# H  K  L  THETA  2THETA D VALUE  1/D**2 SIN2*1000  H  K  L INTENSITY         /F(HKL)/       A(HKL)      B(HKL) PHA.ANG. MULT   LPG
  1  1  1  12.35  24.70   2.3379  0.1830    45.74   1  1  1    1000.0              1.3         1.32         0.00    0.00  8  22.38
  2  0  0  14.30  28.59   2.0247  0.2439    60.99   2  0  0     550.0              1.3         1.30         0.00    0.00  6  16.92
  2  2  0  20.44  40.88   1.4317  0.4879   121.97   2  2  0     503.5              1.2         1.22         0.00    0.00 12   8.75
  3  1  1  24.18  48.35   1.2209  0.6709   167.71   3  1  1     686.4              1.2         1.17         0.00    0.00 24   6.54
  2  2  2  25.32  50.65   1.1689  0.7318   182.96   2  2  2     205.3              1.1         1.15         0.00    0.00  8   6.05
  4  0  0  29.60  59.20   1.0123  0.9758   243.95   4  0  0     106.3              1.1         1.08         0.00    0.00  6   4.71
  3  3  1  32.56  65.13   0.9290  1.1587   289.69   3  3  1     337.1              1.0         1.03         0.00    0.00 24   4.10
  4  2  0  33.52  67.04   0.9055  1.2197   304.93   4  2  0     314.0              1.0         1.02         0.00    0.00 24   3.93
  4  2  2  37.22  74.45   0.8266  1.4637   365.92   4  2  2     242.5              1.0         0.96         0.00    0.00 24   3.43
  5  1  1  39.91  79.82   0.7793  1.6466   411.66   5  1  1     204.2              0.9         0.91         0.00    0.00 24   3.17
  3  3  3  39.91  79.82   0.7793  1.6466   411.66   3  3  3      68.1              0.9         0.91         0.00    0.00  8   3.17
  4  4  0  44.31  88.61   0.7158  1.9516   487.89   4  4  0      79.3              0.8         0.85         0.00    0.00 12   2.86
  5  3  1  46.93  93.86   0.6845  2.1345   533.63   5  3  1     277.3              0.8         0.81         0.00    0.00 48   2.74
  4  4  2  47.81  95.61   0.6749  2.1955   548.88   4  4  2     132.9              0.8         0.80         0.00    0.00 24   2.71
  6  0  0  47.81  95.61   0.6749  2.1955   548.88   6  0  0      33.2              0.8         0.80         0.00    0.00  6   2.71
  6  2  0  51.35 102.69   0.6403  2.4395   609.87   6  2  0     113.9              0.7         0.75         0.00    0.00 24   2.63
  5  3  3  54.07 108.13   0.6175  2.6224   655.61   5  3  3     102.9              0.7         0.72         0.00    0.00 24   2.60
  6  2  2  54.99 109.98   0.6105  2.6834   670.85   6  2  2      99.8              0.7         0.71         0.00    0.00 24   2.60
  4  4  4  58.81 117.63   0.5845  2.9274   731.84   4  4  4      29.9              0.7         0.66         0.00    0.00  8   2.64
  5  5  1  61.86 123.72   0.5670  3.1103   777.58   5  5  1      84.6              0.6         0.63         0.00    0.00 24   2.73
  7  1  1  61.86 123.72   0.5670  3.1103   777.58   7  1  1      84.6              0.6         0.63         0.00    0.00 24   2.73
  6  4  0  62.92 125.85   0.5615  3.1713   792.83   6  4  0      83.4              0.6         0.62         0.00    0.00 24   2.77
  6  4  2  67.52 135.04   0.5411  3.4153   853.82   6  4  2     163.1              0.6         0.59         0.00    0.00 48   3.06
  5  5  3  71.52 143.05   0.5272  3.5982   899.56   5  5  3      85.2              0.6         0.56         0.00    0.00 24   3.51
  7  3  1  71.52 143.05   0.5272  3.5982   899.56   7  3  1     170.5              0.6         0.56         0.00    0.00 48   3.51
  8  0  0  81.05 162.10   0.5062  3.9032   975.79   8  0  0      34.4              0.5         0.52         0.00    0.00  6   6.59