View EntryDate of entry : 19/02/2015


Structural Impact of Platinum on the Incommensurably Modulated γ-Brass
Related Composite Structure Pd15Zn54

Jana, Partha P.; Sven Lidin, Inorganic Chemistry 51 9893 - 9901 (2012)

[ B-IncStrDB ID: 10302EcbVDs ]
 
Submitted by : Samuel [UPV/EHU]CIF File

II

W-Matrix :: 1 : 1-st subsystem

1 0 0 0
0 1 0 0
0 0 1 0
0 0 0 1

W-Matrix :: 2 : 2-nd subsystem

1 0 0 1
0 1 0 0
0 0 1 0
0 0 0 1

Chemical Properties

Structural Formula Sum: Pd2.496 Pm3.965 Pt1.504 Zn26.546   [Help]
Weight: 2869.5 Daltons  [Help]

Crystallographic Properties

a: 4.2837(11) Å  [Help]
b: 9.151(2) Å  [Help]
c: 12.948(4) Å  [Help]
α: 90 °  [Help]
β: 90 °  [Help]
γ: 90 °  [Help]
Volume: 507.6(2) Å3  [Help]
Crystal System: orthorhombic   [Help]
Space Group Name: Fmmm(α00)0s0   [Help]
Number of Formula Units: 1   [Help]

  •  Additional Crystal Information   

Experimental Data

Absorption_coeff_μ: 53.65 &mm;  [Help]
Absorption-correction type: multi-scan   [Help]
Minimum transmission factor: 0.207   [Help]
Maximum transmission factor: 1   [Help]
Intensity Measure Temperature: 293 K  [Help]
Radiation Type: Mo Kα   [Help]
Radiation Wavelength: 0.7107 Å  [Help]
Radiation source: Enhance (Mo) x-ray Source   [Help]
Area detector resolution: 16.1367   [Help]
Intensities measure method: ω scans   [Help]
Total measured intensities #: 12319   [Help]

  •  Additional Experimental Information   

Refinement Properties

Total # of reflections: 1145   [Help]
# of observed reflections: 984   [Help]
Residual factor for the observed reflns.: 0.0335   [Help]

  •  Additional Refinement Information   

Diffraction Data

Intensity Measure Temperature: 293 K  [Help]
Radiation source: Enhance (Mo) x-ray Source   [Help]
Radiation Wavelength: 0.7107 Å  [Help]
_diffrn_radiation_monochromator: graphite   [Help]
_diffrn_measurement_device_type: Xcalibur, Eos   [Help]

  •  Additional Diffraction Data Information   


  •  Reference Structure Information   

  •  Modulation Parameters (Tables)   

  •  Modulation Parameters (Atom Sites Summary)