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Array
(
    [0] => Array
        (
            [id] => 1429
            [topology] => 4<sup>7</sup>T25
            [link_rcsr] => 
            [in_col] => 7
            [transitivity] => [7(12)(11)6]
            [space_group] => C2/m
            [pearson] => mS28
            [cn] => 4
            [Year] => 2017
            [cn_sort] => 004-
            [topology_str] => 4<sup>7</sup>T25
            [sp_atoms] => 
            [caid] => 403
            [nn] => 0
            [name] => 
            [pressure] => 
            [density] => 3.418
            [e_gap] => 
            [energy] => 0.683
            [bulk_mod] => 409.9
            [shear_mod] => 470.6
            [vicker_hard] => 88.7
            [ref_file] => 
            [publ_year] => 
            [ref] => 
        )

    [1] => Array
        (
            [id] => 1430
            [topology] => 4<sup>7</sup>T25
            [link_rcsr] => 
            [in_col] => 7
            [transitivity] => [7(12)(11)6]
            [space_group] => C2/m
            [pearson] => mS28
            [cn] => 4
            [Year] => 2017
            [cn_sort] => 004-
            [topology_str] => 4<sup>7</sup>T25
            [sp_atoms] => 
            [caid] => 403
            [nn] => 1
            [name] => G94
            [pressure] => 
            [density] => 
            [e_gap] => 
            [energy] => 
            [bulk_mod] => 
            [shear_mod] => 
            [vicker_hard] => 
            [ref_file] => /References/2017_ChemPhysChem_18_873
            [publ_year] => 2017
            [ref] => 
        )

)
General information SACADA Check your allotrope Apps Cite this: Angew. Chem. Int. Ed. 2016, 55, 10962–10976 

SACADA Database Code: 403

Topology: 47T25

# of independent nodes (IN): 7
Transitivity: [7(12)(11)6]
Space Group: C2/m
Pearson: mS28
Coordination Number (CN): 4

Year: 2017

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Style:  Wireframe   Capped sticks   Spacefill   Ball&Sticks
Labels:  No Labels   All Atoms
Translations:  {1x1x1}   {2x2x2}  {3x3x3}
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Data

Name

Pressure, GPa

Density, g/cm³

Gap, eV

Relative energy, eV/atom

Bulk, GPa

Shear, GPa

Vickers, GPa

Refs
47T25 (SACADA #403)3.4180.683409.9470.688.7SACADA¹
G94doi: 10.1002/cphc.201700151 
Elasticity tensor (kBar)¹

11527.2426290.7150739.4043-0.0000-0.0000381.9153
290.715011204.0995878.63190.0000-0.0000-151.0119
739.4043878.631910347.14020.00000.0000-171.3547
-0.00000.00000.00004407.1646-222.82490.0000
-0.0000-0.00000.0000-222.82494904.7109-0.0000
381.9153-151.0119-171.35470.0000-0.00003978.7125

¹ We apply the density functional theory (DFT) approach by using the Vienna Ab Initio Simulation Package (VASP) to calculate the total energy and properties of carbon allotropes.

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© 2016 – 2025 SCTMS  Team References support@sacada.info Cite this: Angew. Chem. Int. Ed. 2016, 55, 10962–10976 
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