SACADA Database Code: 175 Topology: 43T84 # of independent nodes (IN): 3 Transitivity: [3553] Space Group: C2221 Pearson: oS16 Coordination Number (CN): 4 Year: 2011  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
43T84 (SACADA #175)		3.505		0.305				SACADA¹
oC16-I			4.5		411.0		85.8	doi: 10.1103/PhysRevB.84.161411
oC16-I								doi: 10.3103/s1063457613010012
oC16-I								doi: 10.1002/zaac.201300652

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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