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Array
(
    [0] => Array
        (
            [id] => 765
            [topology] => 3<sup>2</sup>,4T201
            [link_rcsr] => 
            [in_col] => 3
            [transitivity] => [3542]
            [space_group] => Pn-3m
            [pearson] => cP80
            [cn] => 3, 4 (9:1)
            [Year] => 2008
            [cn_sort] => 003-004-009-001-
            [topology_str] => 3<sup>2</sup>,4T201
            [caid] => 169
            [nn] => 0
            [name] => 
            [pressure] => 
            [density] => 1.913
            [e_gap] => 
            [energy] => 1.107
            [bulk_mod] => 60.2
            [shear_mod] => 43.5
            [vicker_hard] => 5.3
            [ref_file] => 
            [publ_year] => 
            [ref] => 
        )

    [1] => Array
        (
            [id] => 766
            [topology] => 3<sup>2</sup>,4T201
            [link_rcsr] => 
            [in_col] => 3
            [transitivity] => [3542]
            [space_group] => Pn-3m
            [pearson] => cP80
            [cn] => 3, 4 (9:1)
            [Year] => 2008
            [cn_sort] => 003-004-009-001-
            [topology_str] => 3<sup>2</sup>,4T201
            [caid] => 169
            [nn] => 1
            [name] => AHD C40 (2-fold)
            [pressure] => 
            [density] => 1.88
            [e_gap] => 0.94
            [energy] => 
            [bulk_mod] => 60.31
            [shear_mod] => 
            [vicker_hard] => 
            [ref_file] => /References/2008_PhysRevB_77_113402
            [publ_year] => 2008
            [ref] => 
        )

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

SACADA Database Code: 169

Topology: 32,4T201

# of independent nodes (IN): 3
Transitivity: [3542]
Space Group: Pn-3m
Pearson: cP80
Coordination Number (CN): 3, 4 (9:1)

Year: 2008

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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
32,4T201 (SACADA #169)1.9131.10760.243.55.3SACADA¹
AHD C40 (2-fold)1.880.9460.31doi: 10.1103/PhysRevB.77.113402 
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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