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Array
(
    [0] => Array
        (
            [id] => 900
            [topology] => 3<sup>3</sup>,4T96
            [link_rcsr] => 
            [in_col] => 4
            [transitivity] => [4664]
            [space_group] => Cmmm
            [pearson] => oS24
            [cn] => 3, 4 (2:1)
            [Year] => 2016
            [cn_sort] => 003-004-002-001-
            [topology_str] => 3<sup>3</sup>,4T96
            [caid] => 215
            [nn] => 0
            [name] => 
            [pressure] => 
            [density] => 2.503
            [e_gap] => 
            [energy] => 0.563
            [bulk_mod] => 269.5
            [shear_mod] => 107.3
            [vicker_hard] => 15.5
            [ref_file] => 
            [publ_year] => 
            [ref] => 
        )

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            [cn_sort] => 003-004-002-001-
            [topology_str] => 3<sup>3</sup>,4T96
            [caid] => 215
            [nn] => 1
            [name] => C<sub>24</sub>-D
            [pressure] => 
            [density] => 2.55
            [e_gap] => 1.58
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            [ref_file] => /References/2016_Carbon_109_246
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            [ref] => 
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)
General information SACADA Check your allotrope Cite this: Angew. Chem. Int. Ed. 2016, 55, 10962–10976 

SACADA Database Code: 215

Topology: 33,4T96

# of independent nodes (IN): 4
Transitivity: [4664]
Space Group: Cmmm
Pearson: oS24
Coordination Number (CN): 3, 4 (2:1)

Year: 2016

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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
33,4T96 (SACADA #215)2.5030.563269.5107.315.5SACADA¹
C24-D2.551.58doi: 10.1016/j.carbon.2016.08.015 
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 – 2024 SCTMS  Team References support@sacada.info Cite this: Angew. Chem. Int. Ed. 2016, 55, 10962–10976 
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