Examples of calculations by program RTP
Примеры расчётов по программе RTP

Calculation of the cell edge of UO2 compound (dispersion fuel in Zr matrix)
Расчёт периода для соединения UO2 (дисперсное топливо в Zr матрице)

Calculation results by program RTP.   11 May 2003   13:49
Name: UO2 in Zr           Emission: 1.54051      Lattice: P cubic

 #  |  h  k  l |  2th  | +-2th |   d    |  +-d   |   I   | 2th calc |deviation
 1     1  1  1   28.23    0.05   3.1589   0.0055            28.216     0.014  
 2     2  0  0   32.79    0.05   2.7291   0.0040            32.695     0.095  
 3     2  2  0   46.93    0.05   1.9343   0.0019            46.912     0.018  
 4     3  1  1   55.70    0.05   1.6489   0.0014            55.647     0.053  
 5     2  2  2   58.41    0.05   1.5786   0.0012            58.354     0.056  
 6     4  2  0   77.97    0.05   1.2244   0.0007            78.007    -0.037  
 7     4  2  2   87.10    0.05   1.1180   0.0005            87.171    -0.071  

    Parameter   Error 1    Error 2         Parameter   Error 1    Error 2 
 a=  5.4732     0.0015     0.0014       V= 163.958      0.136      0.124
2th rms dev: 0.060 - well

Calculation of interplanar distances for electron beam diffraction (100 kV), ZrFe2 compound
Расчёт межплоскостных расстояний для электронограммы (100 kV), соединение ZrFe2

Calculation results by program RTP.   11 May 2003   13:53
Name: ZrFe2               Emission: 0.03702      Lattice: P hexagonal

 #  |  h  k  l |  2th  | +-2th |   d    |  +-d   |   I   | 2th calc |deviation
 1     0  0  1    0.256          8.2898                  
 2     1  0  0    0.482          4.3985                  
 3     0  0  2    0.512          4.1449                  
 4     1  0  1    0.546          3.8854                  
 5     1  0  2    0.703          3.0165                  
 6     0  0  3    0.768          2.7633                  
 7     1  1  0    0.835          2.5394                  
 8     1  1  1    0.874          2.4281                  
 9     1  0  3    0.907          2.3398                  
10     2  0  0    0.964          2.1992                  
11     1  1  2    0.980          2.1654                  
12     2  0  1    0.998          2.1257                  
13     0  0  4    1.023          2.0724                  
14     2  0  2    1.092          1.9427                  
15     1  0  4    1.131          1.8748                  
16     1  1  3    1.134          1.8698                  
17     2  0  3    1.233          1.7208                  
18     2  1  0    1.276          1.6625                  
19     0  0  5    1.279          1.6580                  
20     2  1  1    1.301          1.6300                  

    Parameter   Error 1    Error 2         Parameter   Error 1    Error 2 
 a=  5.0789     0.0000     ******     c/a=  1.6322     0.0000     ******
 c=  8.2898     0.0000     ******       V= 185.188      0.000     ******

Indexing and calculation of the cell for U3O7 compound
Подбор индексов и расчёт ячейки для соединения U3O7

Calculation results by program RTP.   11 May 2003   13:55
Name: U3O7                Emission: 1.54051      Lattice: I tetragonal

 #  |  h  k  l |  2th  | +-2th |   d    |  +-d   |   I   | 2th calc |deviation
 1 *   1  0  1   28.53    0.05   3.1260   0.0054            28.513     0.017  
 2 *   0  0  2   32.33    0.05   2.7670   0.0042            32.331    -0.001  
 3     1  1  0   33.37    0.05   2.6830   0.0039            33.392    -0.022  
 4     1  1  2   47.15    0.05   1.9260   0.0019            47.165    -0.015  
 5     2  0  0   47.97    0.05   1.8950   0.0019            47.945     0.025  
 6     1  0  3   55.44    0.05   1.6560   0.0014            55.344     0.096  
 7     2  1  1   56.70    0.05   1.6220   0.0013            56.732    -0.032  
 8     2  0  2   59.05    0.05   1.5630   0.0012            59.015     0.035  
 9     0  0  4   67.69    0.05   1.3830   0.0009            67.674     0.016  
10     2  2  0   70.17    0.05   1.3400   0.0008            70.141     0.029  
11     2  1  3   76.15    0.05   1.2490   0.0007            76.202    -0.052  
12     1  1  4   77.54    0.05   1.2300   0.0007            77.596    -0.056  

    Parameter   Error 1    Error 2         Parameter   Error 1    Error 2 
 a=  3.7916     0.0014     0.0010     c/a=  1.4593     0.0011     0.0008
 c=  5.5331     0.0022     0.0016       V=  79.546      0.089      0.065
2th rms dev: 0.043 - very well
100% lines are described. Probable cell: body centred

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