Database of Zeolite Structures
 
Framework Type EON
Powder Diffraction Pattern for TNU-7
Input Parameters
  Wavelength:  or
  2θ range:
  Step size:
  Polarization factor:
  Background:
  Reference peak is
    peak closest to °2θ
    reflection (hkl)
       scaled to
  Intensity axis:
     
Peak shape
  Pseudo-Voigt: (1-n)Gaussian + n Lorentzian
  FWHM = sqrt (U + V tan θ + W tan2θ)
  Mixing parameter (n): %
  Peak range: FWHM
  Peak width:
    set UVW at: U =   V =   W =
    FWHM =
    FWHM =
  FWHM =
   
Select Output
 
List hkl and intensity
List powder pattern
plot powder pattern
Crystal Data
  Space Group: P m m n   (# 59)   
  Cell parameters: a = 7.5789 Å b = 18.089Å c = 25.853 Å
    α = 90° β = 90° γ = 90 °
  Chemical Formula [Ga12.4Si47.6O120]-EON
  Refinement:
  Comment: second origin choice in IT
  Reference: Warrender, S.J., Wright, P.A. Zhou, W.Z., Lightfoot, P., Camblor, M.A., Shin, C.H., Kim, D.J. and Hong, S.B.
Chem. Mater., 17, 1272-1274 (2005)
  Atomic Coordinates:          
   
Atom
Form Factor
x
y
z
PP
B(iso)
    
  Si1
Si
-0.25 0.1666 -0.0016 0.794 0.02
  Si2
Si
-0.25 0.0774 0.1062 0.794 0.02
  Si3
Si
-0.25 0.1585 0.2092 0.794 0.02
  Si4
Si
0.034 0.1631 -0.0884 0.794 0.02
  Si5
Si
0.04 -0.0223 0.1452 0.794 0.02
  Si6
Si
0.041 0.0569 0.251 0.794 0.02
  Si7
Si
0.25 0.1619 0.3936 0.794 0.02
  Si8
Si
0.25 0.1632 0.5168 0.794 0.02
  Si9
Si
-0.046 0.0512 0.3603 0.794 0.02
  Si10
Si
0.051 -0.055 0.4527 0.794 0.02
  Ga1
Ga
-0.25 0.1666 -0.0016 0.206 0.02
  Ga2
Ga
-0.25 0.0774 0.1062 0.206 0.02
  Ga3
Ga
-0.25 0.1585 0.2092 0.206 0.02
  Ga4
Ga
0.034 0.1631 -0.0884 0.206 0.02
  Ga5
Ga
0.04 -0.0223 0.1452 0.206 0.02
  Ga6
Ga
0.041 0.0569 0.251 0.206 0.02
  Ga7
Ga
0.25 0.1619 0.3936 0.206 0.02
  Ga8
Ga
0.25 0.1632 0.5168 0.206 0.02
  Ga9
Ga
-0.046 0.0512 0.3603 0.206 0.02
  Ga10
Ga
0.051 -0.055 0.4527 0.206 0.02
  O1
O
-0.25 0.25 0.022 1 0.033
  O2
O
-0.25 0.11 0.0472 1 0.033
  O3
O
-0.25 0.147 0.1464 1 0.033
  O4
O
-0.25 0.25 0.21 1 0.033
  O5
O
-0.078 0.141 -0.0356 1 0.033
  O6
O
-0.065 0.0308 0.1049 1 0.033
  O7
O
-0.074 0.1324 0.2415 1 0.033
  O8
O
-0.019 0.25 -0.103 1 0.033
  O9
O
-0.017 0.0004 0.2044 1 0.033
  O10
O
0.25 0.156 -0.078 1 0.033
  O11
O
0.25 -0.009 0.131 1 0.033
  O12
O
0.25 0.081 0.253 1 0.033
  O13
O
-0.011 0.1122 -0.14 1 0.033
  O14
O
-0.02 0.012 0.3033 1 0.033
  O15
O
0.25 0.25 0.381 1 0.033
  O16
O
0.25 0.25 0.532 1 0.033
  O17
O
0.25 0.149 0.4554 1 0.033
  O18
O
0.072 0.1266 0.3669 1 0.033
  O19
O
0.077 0.1286 0.5464 1 0.033
  O20
O
0.039 -0.013 0.3965 1 0.033
  O21
O
0 0 0.5 1 0.033
  O22
O
-0.25 0.071 0.376 1 0.033
  O23
O
-0.25 0.088 0.532 1 0.033
  Na1
Na
0 0 0 0.5 0.02
  Na2
Na
0.25 0.068 0.755 0.5 0.02
  Na3
Na
0.25 0.072 0.04 0.5 0.02
  Na4
Na
0.25 0.25 0.284 0.5 0.02
  Na5
Na
0.25 0.75 0.707 0.5 0.02
  Na6
Na
0.036 0.25 0.306 0.5 0.02
  Na7
Na
0.25 0.75 0.467 0.5 0.02


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