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Starting around 1000 C in air or 1800 C in a neutral or reducing atmosphere, diamond undergoes catastrophic allotropic conversion to graphite. High temp thermodynamic data is therefore mostly compiled for graphite.
Carbon phase diagram
Carbon crystal
structures
Diamond and graphite crystal lattice VRML graphics
Enthalpy of Enthalpy of Entropy Free Energy of
combustion Formation /_\S Formation, /_\G
Kcal/mole cal/mole Kcal/mole
Graphite 93.983 0.00 1.3603 -
Diamond 94.437 0.4540 0.58267 0.684
Temp Equilibrium constant
graphite/diamond
298K 3.18
1273K 1.31
1698K 1.23
Carbon crystal structure (cell dimensions/pm unless otherwise
stated),space group
Cubic diamond (a=0.356688 nm), Fd3m, 0.154450 nm bond
atoms at (000),(0.5,0.5,0),(0,0.5,0.5),(0.5,0,0.5),
(0.25,0.25,0.25),(0.75,0.75,0.25),
(0.25,0.75,0.75),(0.75,0.25,0.75)
Hexagonal graphite (a=246.12,c=670.78),P6_3mc
Rhombohedral graphite (a=364.2,alpha=39deg30'), R3m
Hexagonal diamond (a=252,c=412),P6_3/mmc
Hexagonal (a=894.8, c=1408)
Melting point C: 3820 (diam.); 3800 (graph.); 800 K sublimes
Boiling point, 5100 K
Debye temperature, 402 K (graphite)
5.7 perpendicular, 1960 parallel (graphite) [298 K] W/m-K
enthalpy of fusion, 105.1 kJ/mol (graphite)
enthalpy of vaporization, 710.9 kJ/mol (graphite)
IMPORTANT PROPERTIES OF DIAMOND
(1 GPa = 145,078 psi)
(1 GPa = 10^10 dyne/cm^2)
PROPERTY VALUE
Hardness 10,000 kg/mm^2
90 GPa
5500-8500 Knoop
(Al203 2000, BC 2250, SiC 1875-3980, WC/TiC 2190, VC 2080)
Strength, tensile >1.2 GPa
Strength, compressive >110 GPa
Compressibility
Linear 7.54x10(-11)/Pascal
Volume 2.26x10(-10)/Pascal
(W 3.3x10^(-7) cm^2/kg)
Sound velocity 18,000 m/sec
Density 3.515 g/cm^3
Young's modulus 1.22 GPa
Elastic Moduli C11=10.79 C12=1.24 C44=5.96 x10^12 dynes/cm^2
Bulk modulus 4.42x10^12 x10^12 dynes/cm^2
(W 2.99x10^12 dynes/cm^2)
Poisson's ratio 0.2
Thermal expansion coefficient, 20 C 0.8-1.1 ppm/K (re Invar)
-100 C 0.4 ppm/K (re silica)
100-900 C 1.5-4.8 ppm/K
Thermal conductivity 2000.0 W/cm-K
Type I, 20 C 9 W/cm-K
Type IIa, 20 C 26 W/cm-K
Type I, 190 C 24 W/cm-K
Type IIa, 190 C 120 W/cm-K
(Cu or SiC, 20C 4 W/cm-K)
Thermal shock parameter 3x10^7 W/m
Debye temperature, 0 K 2200 K
0-800 C 1860 K
Specific Heat, 20 C 0.113 cal/gm-K
Optical transmissivity 225 nm to far infrared
Loss tangent at 40 Hz 0.0006
Dielectric constant 5.68 0-3 KHz
Dielectric strength 10^7 V/cm
Electron mobility 2200 cm^2/V-sec
Hole mobility 1600 cm^2/V-sec
Electron saturated velocity 2.7x10^7 cm/sec
Hole saturated velocity 10^7 cm/sec
Work function <0 V (on [111] surface)
Bandgap 5.45 eV
Resistivity 10^13 - 10^16 ohm-cm
Transparency, IIa 225 - 2500 nm, >6000 nm
Ia 340 - 2500 nm, >10,000 nm
Refractive index 2.4173 (Na 589.32 nm)
2.4237 (Hg 546.1 nm)
2.4099 (H-alpha 656.3 nm)
2.7151 (226.5 cutoff)
n^2 = 1 + [(0.3306)(l^2)/[(l^2)-3.0625x10^6)] +
[(4.3356)(l^2)/[(l^2)-1.1236x10^6)]
n=refractive index, l=wavelength, angstroms
Z. Phys. 15 358 (1923)
Crystal structure: Phil. Trans. Roy. Soc. A 240 219 (1947)
Am. Min. 42 39 (1957)
Density: J. Appl. Phys. 35 1773 (1964)
Thermal expansion: Phil. Kag. 1 409 (1956)
Am. Min. 42 39 (1957)
Specific Heat: Phys. Rev. 111 1275 (1958)
Phil. Mag. 3 43 (1958)
J. Chem. Phys. 36 1903 (1962)
Hardness: J. Res. Nat. Bur. Standards 23 (1939)
Elastic Properties: J. Applied Physics 43 2944 (1972)
Proc. Roy. Soc. A 187 381 (1946)
Acta Cryst. 6 450 (1953)
Phys. Rev. 105 116 (1957)
The bandgap of diamond at ambient is 5.45 eV. The energy of the
boron impurity level in diamond is 0.37 eV above the valence
band. Depending on how much and how N goes into diamond the
energy level is somewhere between 1.7 and 2.0 below the
conduction band.
(The experiment was done by JPL in the 92 to 95 timeframe and
reported in several journals. Measurements were made to 1100 or
1200 C for both nitrogen doped and undoped diamond.)
"Typical" N-doped diamond has a resistivity of 10^18 ohm-cm at
ambient. Type IIb 10-1000 ohm-cm. Strong photoconductivity with
UV. Changing the temperature gives you a factor of exp(-T1/T2),
T in degrees K. At 1000 C therefore about 10^16 ohm-cm.
--
Uncle Al
Do
something naughty to physics
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