SACADA Database Code: 525 Topology: 3,42T7-CA # of independent nodes (IN): 3 Transitivity: [3543] Space Group: Pm-3 Pearson: cP30 Coordination Number (CN): 3, 4 (1:2) Year: 2022  Download CIF File  Download PDF report

Style:  Wireframe   Capped sticks   Spacefill   Ball&Sticks Labels:  No Labels   All Atoms Translations:  {1x1x1}   {2x2x2}  {3x3x3}   Fullscreen Mode  Fullscreen Mode (Close)

Data

Name	Pressure, GPa	Density, g/cm³	Gap, eV	Relative energy, eV/atom	Bulk, GPa	Shear, GPa	Vickers, GPa	Refs
3,42T7-CA (SACADA #525)		2.54		1.2005	279.3	177.4	21.3	SACADA¹
3nodal	12-13	2.5	1.33		268		21.6	doi: 10.1016/j.carbon.2022.03.055

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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