xxx 
Array
(
    [0] => Array
        (
            [id] => 1257
            [topology] => 3,4<sup>11</sup>T2
            [link_rcsr] => 
            [in_col] => 12
            [transitivity] => [(12)(19)(17)(10)]
            [space_group] => C2/m
            [pearson] => mS48
            [cn] => 3, 4 (1:11)
            [Year] => 2013
            [cn_sort] => 003-004-001-011-
            [topology_str] => 3,4<sup>11</sup>T2
            [sp_atoms] => 
            [caid] => 325
            [nn] => 0
            [name] => 
            [pressure] => 
            [density] => 3.481
            [e_gap] => 
            [energy] => 0.675
            [bulk_mod] => 420.6
            [shear_mod] => 481.1
            [vicker_hard] => 90.6
            [ref_file] => 
            [publ_year] => 
            [ref] => 
        )

    [1] => Array
        (
            [id] => 1258
            [topology] => 3,4<sup>11</sup>T2
            [link_rcsr] => 
            [in_col] => 12
            [transitivity] => [(12)(19)(17)(10)]
            [space_group] => C2/m
            [pearson] => mS48
            [cn] => 3, 4 (1:11)
            [Year] => 2013
            [cn_sort] => 003-004-001-011-
            [topology_str] => 3,4<sup>11</sup>T2
            [sp_atoms] => 
            [caid] => 325
            [nn] => 1
            [name] => 24C
            [pressure] => 20
            [density] => 
            [e_gap] => 
            [energy] => 
            [bulk_mod] => 
            [shear_mod] => 
            [vicker_hard] => 
            [ref_file] => /References/2013_PhysRev_B_88_014102
            [publ_year] => 2013
            [ref] => 
        )

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

SACADA Database Code: 325

Topology: 3,411T2

# of independent nodes (IN): 12
Transitivity: [(12)(19)(17)(10)]
Space Group: C2/m
Pearson: mS48
Coordination Number (CN): 3, 4 (1:11)

Year: 2013

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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
3,411T2 (SACADA #325)3.4810.675420.6481.190.6SACADA¹
24C20doi: 10.1103/PhysRevB.88.014102 
Elasticity tensor (kBar)¹

11362.2562710.9584965.2161-0.0000-0.0000558.4779
710.958410366.5921564.1226-0.00000.0000-345.2129
965.2161564.122611717.3908-0.0000-0.0000-309.3049
-0.0000-0.0000-0.00004293.6215-382.64500.0000
-0.00000.0000-0.0000-382.64504347.3095-0.0000
558.4779-345.2129-309.30490.0000-0.00005116.1710

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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