Dynamical matrix file
File generated with the CellConstructor by Lorenzo Monacelli
3 5 0     1.8897259890000000     0.0000000000000000     0.0000000000000000     0.0000000000000000     0.0000000000000000     0.0000000000000000
Basis vectors
    4.0008305450633186     0.0000000000000000     0.0000000000000000
    0.0000000000000000     4.0008305450633186     0.0000000000000000
    0.0000000000000000     0.0000000000000000     4.0008305450633186
	1  'Ba '  125165.9077335107867839
	2  'Ti '  43628.1030349454958923
	3  'O '  14582.1969301625977096
    1     1     0.0000000000000000     0.0000000000000000     0.0000000000000000
    2     2     2.0004152725316593     2.0004152725316593     2.0004152725316593
    3     3     0.0000000000000000     2.0004152725316593     2.0004152725316593
    4     3     2.0004152725316593     0.0000000000000000     2.0004152725316593
    5     3     2.0004152725316593     2.0004152725316593     0.0000000000000000

     Dynamical Matrix in cartesian axes

     q = (     0.000000000000     0.000000000000     0.000000000000 )

    1    1
     0.1377285235060291     0.0000000000000000        0.0000000000000000     0.0000000000000000        0.0000000000000000     0.0000000000000000
     0.0000000000000000     0.0000000000000000        0.1377285235060291     0.0000000000000000        0.0000000000000000     0.0000000000000000
     0.0000000000000000     0.0000000000000000        0.0000000000000000     0.0000000000000000        0.1377285235060291     0.0000000000000000
    1    2
    -0.0762134056550549     0.0000000000000000        0.0000000000000000     0.0000000000000000        0.0000000000000000     0.0000000000000000
     0.0000000000000000     0.0000000000000000       -0.0762134056550549     0.0000000000000000        0.0000000000000000     0.0000000000000000
     0.0000000000000000     0.0000000000000000        0.0000000000000000     0.0000000000000000       -0.0762134056550549     0.0000000000000000
    1    3
    -0.0303650783431391     0.0000000000000000        0.0000000000000000     0.0000000000000000        0.0000000000000000     0.0000000000000000
     0.0000000000000000     0.0000000000000000       -0.0155750197539175     0.0000000000000000        0.0000000000000000     0.0000000000000000
     0.0000000000000000     0.0000000000000000        0.0000000000000000     0.0000000000000000       -0.0155750197539175     0.0000000000000000
    1    4
    -0.0155750197539175     0.0000000000000000        0.0000000000000000     0.0000000000000000        0.0000000000000000     0.0000000000000000
     0.0000000000000000     0.0000000000000000       -0.0303650783431391     0.0000000000000000        0.0000000000000000     0.0000000000000000
     0.0000000000000000     0.0000000000000000        0.0000000000000000     0.0000000000000000       -0.0155750197539175     0.0000000000000000
    1    5
    -0.0155750197539175     0.0000000000000000        0.0000000000000000     0.0000000000000000        0.0000000000000000     0.0000000000000000
     0.0000000000000000     0.0000000000000000       -0.0155750197539175     0.0000000000000000        0.0000000000000000     0.0000000000000000
     0.0000000000000000     0.0000000000000000        0.0000000000000000     0.0000000000000000       -0.0303650783431391     0.0000000000000000
    2    1
    -0.0762134056550549     0.0000000000000000        0.0000000000000000     0.0000000000000000        0.0000000000000000     0.0000000000000000
     0.0000000000000000     0.0000000000000000       -0.0762134056550549     0.0000000000000000        0.0000000000000000     0.0000000000000000
     0.0000000000000000     0.0000000000000000        0.0000000000000000     0.0000000000000000       -0.0762134056550549     0.0000000000000000
    2    2
     0.0873440942869664     0.0000000000000000        0.0000000000000000     0.0000000000000000        0.0000000000000000     0.0000000000000000
     0.0000000000000000     0.0000000000000000        0.0873440942869664     0.0000000000000000        0.0000000000000000     0.0000000000000000
     0.0000000000000000     0.0000000000000000        0.0000000000000000     0.0000000000000000        0.0873440942869664     0.0000000000000000
    2    3
     0.0365293607232799     0.0000000000000000        0.0000000000000000     0.0000000000000000        0.0000000000000000     0.0000000000000000
     0.0000000000000000     0.0000000000000000       -0.0238300246775956     0.0000000000000000        0.0000000000000000     0.0000000000000000
     0.0000000000000000     0.0000000000000000        0.0000000000000000     0.0000000000000000       -0.0238300246775956     0.0000000000000000
    2    4
    -0.0238300246775956     0.0000000000000000        0.0000000000000000     0.0000000000000000        0.0000000000000000     0.0000000000000000
     0.0000000000000000     0.0000000000000000        0.0365293607232799     0.0000000000000000        0.0000000000000000     0.0000000000000000
     0.0000000000000000     0.0000000000000000        0.0000000000000000     0.0000000000000000       -0.0238300246775956     0.0000000000000000
    2    5
    -0.0238300246775956     0.0000000000000000        0.0000000000000000     0.0000000000000000        0.0000000000000000     0.0000000000000000
     0.0000000000000000     0.0000000000000000       -0.0238300246775956     0.0000000000000000        0.0000000000000000     0.0000000000000000
     0.0000000000000000     0.0000000000000000        0.0000000000000000     0.0000000000000000        0.0365293607232799     0.0000000000000000
    3    1
    -0.0303650783431391     0.0000000000000000        0.0000000000000000     0.0000000000000000        0.0000000000000000     0.0000000000000000
     0.0000000000000000     0.0000000000000000       -0.0155750197539175     0.0000000000000000        0.0000000000000000     0.0000000000000000
     0.0000000000000000     0.0000000000000000        0.0000000000000000     0.0000000000000000       -0.0155750197539175     0.0000000000000000
    3    2
     0.0365293607232799     0.0000000000000000        0.0000000000000000     0.0000000000000000        0.0000000000000000     0.0000000000000000
     0.0000000000000000     0.0000000000000000       -0.0238300246775956     0.0000000000000000        0.0000000000000000     0.0000000000000000
     0.0000000000000000     0.0000000000000000        0.0000000000000000     0.0000000000000000       -0.0238300246775956     0.0000000000000000
    3    3
     0.1669490813220953     0.0000000000000000        0.0000000000000000     0.0000000000000000        0.0000000000000000     0.0000000000000000
     0.0000000000000000     0.0000000000000000        0.1128316729181312     0.0000000000000000        0.0000000000000000     0.0000000000000000
     0.0000000000000000     0.0000000000000000        0.0000000000000000     0.0000000000000000        0.1128316729181312     0.0000000000000000
    3    4
    -0.0865566818511180     0.0000000000000000        0.0000000000000000     0.0000000000000000        0.0000000000000000     0.0000000000000000
     0.0000000000000000     0.0000000000000000       -0.0865566818511180     0.0000000000000000        0.0000000000000000     0.0000000000000000
     0.0000000000000000     0.0000000000000000        0.0000000000000000     0.0000000000000000        0.0131300533644998     0.0000000000000000
    3    5
    -0.0865566818511180     0.0000000000000000        0.0000000000000000     0.0000000000000000        0.0000000000000000     0.0000000000000000
     0.0000000000000000     0.0000000000000000        0.0131300533644998     0.0000000000000000        0.0000000000000000     0.0000000000000000
     0.0000000000000000     0.0000000000000000        0.0000000000000000     0.0000000000000000       -0.0865566818511180     0.0000000000000000
    4    1
    -0.0155750197539175     0.0000000000000000        0.0000000000000000     0.0000000000000000        0.0000000000000000     0.0000000000000000
     0.0000000000000000     0.0000000000000000       -0.0303650783431391     0.0000000000000000        0.0000000000000000     0.0000000000000000
     0.0000000000000000     0.0000000000000000        0.0000000000000000     0.0000000000000000       -0.0155750197539175     0.0000000000000000
    4    2
    -0.0238300246775956     0.0000000000000000        0.0000000000000000     0.0000000000000000        0.0000000000000000     0.0000000000000000
     0.0000000000000000     0.0000000000000000        0.0365293607232799     0.0000000000000000        0.0000000000000000     0.0000000000000000
     0.0000000000000000     0.0000000000000000        0.0000000000000000     0.0000000000000000       -0.0238300246775956     0.0000000000000000
    4    3
    -0.0865566818511180     0.0000000000000000        0.0000000000000000     0.0000000000000000        0.0000000000000000     0.0000000000000000
     0.0000000000000000     0.0000000000000000       -0.0865566818511180     0.0000000000000000        0.0000000000000000     0.0000000000000000
     0.0000000000000000     0.0000000000000000        0.0000000000000000     0.0000000000000000        0.0131300533644998     0.0000000000000000
    4    4
     0.1128316729181312     0.0000000000000000        0.0000000000000000     0.0000000000000000        0.0000000000000000     0.0000000000000000
     0.0000000000000000     0.0000000000000000        0.1669490813220953     0.0000000000000000        0.0000000000000000     0.0000000000000000
     0.0000000000000000     0.0000000000000000        0.0000000000000000     0.0000000000000000        0.1128316729181312     0.0000000000000000
    4    5
     0.0131300533644998     0.0000000000000000        0.0000000000000000     0.0000000000000000        0.0000000000000000     0.0000000000000000
     0.0000000000000000     0.0000000000000000       -0.0865566818511180     0.0000000000000000        0.0000000000000000     0.0000000000000000
     0.0000000000000000     0.0000000000000000        0.0000000000000000     0.0000000000000000       -0.0865566818511180     0.0000000000000000
    5    1
    -0.0155750197539175     0.0000000000000000        0.0000000000000000     0.0000000000000000        0.0000000000000000     0.0000000000000000
     0.0000000000000000     0.0000000000000000       -0.0155750197539175     0.0000000000000000        0.0000000000000000     0.0000000000000000
     0.0000000000000000     0.0000000000000000        0.0000000000000000     0.0000000000000000       -0.0303650783431391     0.0000000000000000
    5    2
    -0.0238300246775956     0.0000000000000000        0.0000000000000000     0.0000000000000000        0.0000000000000000     0.0000000000000000
     0.0000000000000000     0.0000000000000000       -0.0238300246775956     0.0000000000000000        0.0000000000000000     0.0000000000000000
     0.0000000000000000     0.0000000000000000        0.0000000000000000     0.0000000000000000        0.0365293607232799     0.0000000000000000
    5    3
    -0.0865566818511180     0.0000000000000000        0.0000000000000000     0.0000000000000000        0.0000000000000000     0.0000000000000000
     0.0000000000000000     0.0000000000000000        0.0131300533644998     0.0000000000000000        0.0000000000000000     0.0000000000000000
     0.0000000000000000     0.0000000000000000        0.0000000000000000     0.0000000000000000       -0.0865566818511180     0.0000000000000000
    5    4
     0.0131300533644998     0.0000000000000000        0.0000000000000000     0.0000000000000000        0.0000000000000000     0.0000000000000000
     0.0000000000000000     0.0000000000000000       -0.0865566818511180     0.0000000000000000        0.0000000000000000     0.0000000000000000
     0.0000000000000000     0.0000000000000000        0.0000000000000000     0.0000000000000000       -0.0865566818511180     0.0000000000000000
    5    5
     0.1128316729181312     0.0000000000000000        0.0000000000000000     0.0000000000000000        0.0000000000000000     0.0000000000000000
     0.0000000000000000     0.0000000000000000        0.1128316729181312     0.0000000000000000        0.0000000000000000     0.0000000000000000
     0.0000000000000000     0.0000000000000000        0.0000000000000000     0.0000000000000000        0.1669490813220953     0.0000000000000000

     Diagonalizing the dynamical matrix

     q = (     0.000000000000     0.000000000000     0.000000000000 )

***************************************************************************
   freq (    1) =     0.00000005 [THz] =     0.00000160 [cm-1]
(   0.086496  0.000000  -0.173721  0.000000  -0.402914  0.000000 )
(   0.086496  0.000000  -0.173721  0.000000  -0.402914  0.000000 )
(   0.086496  0.000000  -0.173721  0.000000  -0.402914  0.000000 )
(   0.086496  0.000000  -0.173721  0.000000  -0.402914  0.000000 )
(   0.086496  0.000000  -0.173721  0.000000  -0.402914  0.000000 )
   freq (    2) =     0.00000017 [THz] =     0.00000583 [cm-1]
(   0.438719  0.000000   0.040481  0.000000   0.076728  0.000000 )
(   0.438719  0.000000   0.040481  0.000000   0.076728  0.000000 )
(   0.438719  0.000000   0.040481  0.000000   0.076728  0.000000 )
(   0.438719  0.000000   0.040481  0.000000   0.076728  0.000000 )
(   0.438719  0.000000   0.040481  0.000000   0.076728  0.000000 )
   freq (    3) =     0.00000023 [THz] =     0.00000782 [cm-1]
(  -0.006666  0.000000   0.410100  0.000000  -0.178251  0.000000 )
(  -0.006666  0.000000   0.410100  0.000000  -0.178251  0.000000 )
(  -0.006666  0.000000   0.410100  0.000000  -0.178251  0.000000 )
(  -0.006666  0.000000   0.410100  0.000000  -0.178251  0.000000 )
(  -0.006666  0.000000   0.410100  0.000000  -0.178251  0.000000 )
   freq (    4) =     4.30058165 [THz] =   143.45194222 [cm-1]
(  -0.000251  0.000000   0.012504  0.000000   0.038930  0.000000 )
(  -0.002482  0.000000   0.123464  0.000000   0.384390  0.000000 )
(   0.003992  0.000000  -0.139067  0.000000  -0.432970  0.000000 )
(   0.002795  0.000000  -0.198583  0.000000  -0.432970  0.000000 )
(   0.002795  0.000000  -0.139067  0.000000  -0.618264  0.000000 )
   freq (    5) =     4.30058165 [THz] =   143.45194222 [cm-1]
(  -0.040880  0.000000  -0.000893  0.000000   0.000023  0.000000 )
(  -0.403643  0.000000  -0.008821  0.000000   0.000227  0.000000 )
(   0.649231  0.000000   0.009936  0.000000  -0.000256  0.000000 )
(   0.454655  0.000000   0.014188  0.000000  -0.000256  0.000000 )
(   0.454655  0.000000   0.009936  0.000000  -0.000366  0.000000 )
   freq (    6) =     4.30058165 [THz] =   143.45194222 [cm-1]
(  -0.000858  0.000000   0.038921  0.000000  -0.012507  0.000000 )
(  -0.008468  0.000000   0.384297  0.000000  -0.123489  0.000000 )
(   0.013620  0.000000  -0.432865  0.000000   0.139095  0.000000 )
(   0.009538  0.000000  -0.618114  0.000000   0.139095  0.000000 )
(   0.009538  0.000000  -0.432865  0.000000   0.198623  0.000000 )
   freq (    7) =     5.39440014 [THz] =   179.93779460 [cm-1]
(   0.013559  0.000000  -0.270538  0.000000   0.229701  0.000000 )
(  -0.023427  0.000000   0.467436  0.000000  -0.396877  0.000000 )
(  -0.012783  0.000000   0.334297  0.000000  -0.283835  0.000000 )
(  -0.016755  0.000000   0.255054  0.000000  -0.283835  0.000000 )
(  -0.016755  0.000000   0.334297  0.000000  -0.216554  0.000000 )
   freq (    8) =     5.39440014 [THz] =   179.93779460 [cm-1]
(   0.085876  0.000000   0.225538  0.000000   0.260567  0.000000 )
(  -0.148377  0.000000  -0.389685  0.000000  -0.450207  0.000000 )
(  -0.080961  0.000000  -0.278692  0.000000  -0.321975  0.000000 )
(  -0.106115  0.000000  -0.212630  0.000000  -0.321975  0.000000 )
(  -0.106115  0.000000  -0.278692  0.000000  -0.245653  0.000000 )
   freq (    9) =     5.39440014 [THz] =   179.93779460 [cm-1]
(   0.344352  0.000000  -0.045593  0.000000  -0.074026  0.000000 )
(  -0.594972  0.000000   0.078776  0.000000   0.127902  0.000000 )
(  -0.324643  0.000000   0.056338  0.000000   0.091472  0.000000 )
(  -0.425507  0.000000   0.042984  0.000000   0.091472  0.000000 )
(  -0.425507  0.000000   0.056338  0.000000   0.069789  0.000000 )
   freq (   10) =     8.60230628 [THz] =   286.94201013 [cm-1]
(   0.000000  0.000000   0.000000  0.000000  -0.000000  0.000000 )
(  -0.000000  0.000000   0.000000  0.000000   0.000000  0.000000 )
(  -0.000000  0.000000  -0.000000  0.000000   0.707107  0.000000 )
(   0.000000  0.000000   0.000000  0.000000  -0.707107  0.000000 )
(  -0.000000  0.000000   0.000000  0.000000  -0.000000  0.000000 )
   freq (   11) =     8.60230628 [THz] =   286.94201013 [cm-1]
(   0.000000  0.000000   0.000000  0.000000  -0.000000  0.000000 )
(   0.000000  0.000000  -0.000000  0.000000  -0.000000  0.000000 )
(  -0.000000  0.000000  -0.683960  0.000000  -0.000000  0.000000 )
(  -0.179440  0.000000  -0.000000  0.000000   0.000000  0.000000 )
(   0.179440  0.000000   0.683960  0.000000   0.000000  0.000000 )
   freq (   12) =     8.60230628 [THz] =   286.94201013 [cm-1]
(   0.000000  0.000000  -0.000000  0.000000  -0.000000  0.000000 )
(   0.000000  0.000000   0.000000  0.000000   0.000000  0.000000 )
(   0.000000  0.000000   0.179440  0.000000   0.000000  0.000000 )
(  -0.683960  0.000000   0.000000  0.000000  -0.000000  0.000000 )
(   0.683960  0.000000  -0.179440  0.000000  -0.000000  0.000000 )
   freq (   13) =    14.26129292 [THz] =   475.70545880 [cm-1]
(   0.006386  0.000000  -0.000000  0.000000   0.000000  0.000000 )
(  -0.068292  0.000000   0.000000  0.000000  -0.000000  0.000000 )
(  -0.761684  0.000000  -0.000000  0.000000  -0.000000  0.000000 )
(   0.455594  0.000000   0.000000  0.000000  -0.000000  0.000000 )
(   0.455594  0.000000  -0.000000  0.000000   0.000000  0.000000 )
   freq (   14) =    14.26129292 [THz] =   475.70545880 [cm-1]
(   0.000000  0.000000   0.006252  0.000000  -0.001302  0.000000 )
(  -0.000000  0.000000  -0.066858  0.000000   0.013924  0.000000 )
(  -0.000000  0.000000   0.446025  0.000000  -0.092888  0.000000 )
(   0.000000  0.000000  -0.745685  0.000000  -0.092888  0.000000 )
(  -0.000000  0.000000   0.446025  0.000000   0.155295  0.000000 )
   freq (   15) =    14.26129292 [THz] =   475.70545880 [cm-1]
(  -0.000000  0.000000  -0.001302  0.000000  -0.006252  0.000000 )
(   0.000000  0.000000   0.013924  0.000000   0.066858  0.000000 )
(   0.000000  0.000000  -0.092888  0.000000  -0.446025  0.000000 )
(  -0.000000  0.000000   0.155295  0.000000  -0.446025  0.000000 )
(  -0.000000  0.000000  -0.092888  0.000000   0.745685  0.000000 )
***************************************************************************
