Computing the properties of materials from first principles with SIESTA
N Kaltsoyannis, JE McGrady, D Sánchez-Portal… - … and applications of …, 2004 - Springer
SIESTA was developed as an approach to compute the electronic properties and perform
atomistic simulations of complex materials from first principles. Very large systems, with an …
atomistic simulations of complex materials from first principles. Very large systems, with an …
Superconductivity in carrier-doped silicon carbide
T Muranaka, Y Kikuchi, T Yoshizawa… - … and Technology of …, 2009 - iopscience.iop.org
We report growth and characterization of heavily boron-doped 3C-SiC and 6H-SiC and Al-
doped 3C-SiC. Both 3C-SiC: B and 6H-SiC: B reveal type-I superconductivity with a critical …
doped 3C-SiC. Both 3C-SiC: B and 6H-SiC: B reveal type-I superconductivity with a critical …
Aggregation of carbon interstitials in silicon carbide: A theoretical study
Ab initio supercell calculations have been carried out to investigate clusters of carbon
interstitials in 3C-and 4H-SiC. Based on the calculated formation energies, the complex …
interstitials in 3C-and 4H-SiC. Based on the calculated formation energies, the complex …
Superconductivity in boron-doped SiC
ZA Ren, J Kato, T Muranaka, J Akimitsu… - Journal of the Physical …, 2007 - journals.jps.jp
We report superconductivity in heavily boron-doped bulk silicon carbide related to the
diamond structure. The compound exhibits zero resistivity and diamagnetic susceptibility …
diamond structure. The compound exhibits zero resistivity and diamagnetic susceptibility …
Effect of boron doping on microwave dielectric properties of SiC powder synthesized by combustion synthesis
Z Li, W Zhou, X Su, F Luo, Y Huang, C Wang - Journal of alloys and …, 2011 - Elsevier
Boron-doped SiC powders were synthesized from the Si/C/B system in a nitrogen
atmosphere by combustion synthesis. Results showed that boron benefited the …
atmosphere by combustion synthesis. Results showed that boron benefited the …
Different roles of carbon and silicon interstitials in the interstitial-mediated boron diffusion in
M Bockstedte, A Mattausch, O Pankratov - Physical Review B—Condensed …, 2004 - APS
The interstitial and vacancy mediated boron diffusion in silicon carbide is investigated with
an ab initio method. The boron interstitials in p-type and n-type materials are found to be far …
an ab initio method. The boron interstitials in p-type and n-type materials are found to be far …
Microwave dielectric properties of SiC (B) solid solution powder prepared by sol–gel
Z Li, W Zhou, T Lei, F Luo, Y Huang, Q Cao - Journal of alloys and …, 2009 - Elsevier
B-doped SiC powders were synthesized at different temperatures by sol–gel. Results show
that C-enriched β-SiC is generated completely when the temperature is 1700° C and SiC (B) …
that C-enriched β-SiC is generated completely when the temperature is 1700° C and SiC (B) …
Specific heat and electronic states of superconducting boron-doped silicon carbide
The discoveries of superconductivity in the heavily-boron doped semiconductors diamond
(C: B) in 2004 [Ekimov, Nature (London) 428, 542 (2004) NATUAS 10.1038/nature02449] …
(C: B) in 2004 [Ekimov, Nature (London) 428, 542 (2004) NATUAS 10.1038/nature02449] …
Self-diffusion in isotopically enriched silicon carbide and its correlation with dopant diffusion
K Rüschenschmidt, H Bracht, NA Stolwijk… - Journal of Applied …, 2004 - pubs.aip.org
Diffusion of C 13 and Si 30 in silicon carbide was performed with isotopically enriched 4 H-
Si 28 C 12∕ nat SiC heterostructures which were grown by chemical vapor phase epitaxy …
Si 28 C 12∕ nat SiC heterostructures which were grown by chemical vapor phase epitaxy …
Kick-out diffusion of Al in 4H-SiC: an ab initio study
Y Huang, Y Qian, Y Zhang, D Yang, X Pi - Journal of Applied Physics, 2022 - pubs.aip.org
As a semiconductor with a wide bandgap, 4H silicon carbide (4H-SiC) has considerable
potential for high-temperature and high-power devices. It is widely established that p-type …
potential for high-temperature and high-power devices. It is widely established that p-type …