SACADA Database Code: 173 Topology: mct # of independent nodes (IN): 3 Transitivity: [3552] Space Group: Im-3m Pearson: cI192 Coordination Number (CN): 3 Year: 1991  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
mct (SACADA #173)		1.161		0.052				SACADA¹
P8								doi: 10.1038/352762a0
P8		1.16			103			doi: 10.1016/0008-6223(92)90066-6
P192								doi: 10.1103/PhysRevLett.69.921
P192								doi: 10.1103/PhysRevB.46.1941
P8								doi: 10.1098/rsta.1993.0045
P8								doi: 10.1016/0009-2614(93)85009-d
P8								link
P8		1.14			114			doi: 10.1016/0956-7151(94)90210-0
P8								link
P192								doi: 10.1021/jp9613201
P8								doi: 10.1016/s0960-8974(97)00003-x
P8								doi: 10.1088/1367-2630/5/1/126
P8			1.4		149	54.3		doi: 10.1088/1367-2630/5/1/123

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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