SACADA Database Code: 418 Topology: 416T9 # of independent nodes (IN): 16 Transitivity: [(16)(32)(23)7] Space Group: P1 Pearson: aP16 Coordination Number (CN): 4 Year: 2017  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
416T9 (SACADA #418)		3.350		0.347				SACADA¹
G118								doi: 10.1002/cphc.201700151

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.

Click here for more details