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Simultaneously B- and P-doped silicon nanoclusters: Formation energies and electronic properties
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Zeitschriftentitel: | Applied Physics Letters |
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Personen und Körperschaften: | , , , , , , , |
In: | Applied Physics Letters, 87, 2005, 17 |
Format: | E-Article |
Sprache: | Englisch |
veröffentlicht: |
AIP Publishing
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author_facet |
Ossicini, S. Degoli, E. Iori, F. Luppi, E. Magri, R. Cantele, G. Trani, F. Ninno, D. Ossicini, S. Degoli, E. Iori, F. Luppi, E. Magri, R. Cantele, G. Trani, F. Ninno, D. |
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author |
Ossicini, S. Degoli, E. Iori, F. Luppi, E. Magri, R. Cantele, G. Trani, F. Ninno, D. |
spellingShingle |
Ossicini, S. Degoli, E. Iori, F. Luppi, E. Magri, R. Cantele, G. Trani, F. Ninno, D. Applied Physics Letters Simultaneously B- and P-doped silicon nanoclusters: Formation energies and electronic properties Physics and Astronomy (miscellaneous) |
author_sort |
ossicini, s. |
spelling |
Ossicini, S. Degoli, E. Iori, F. Luppi, E. Magri, R. Cantele, G. Trani, F. Ninno, D. 0003-6951 1077-3118 AIP Publishing Physics and Astronomy (miscellaneous) http://dx.doi.org/10.1063/1.2119424 <jats:p>The effects of B and P codoping on the impurity formation energies and electronic properties of Si nanocrystals (Si-nc) are calculated by a first-principles method. We show that, if carriers in the Si-nc are perfectly compensated by simultaneous doping with n- and p-type impurities, the Si-nc undergo a minor structural distortion around the impurities and that the formation energies are always smaller than those for the corresponding single-doped cases. The band gap of the codoped Si-nc is strongly reduced with respect to the gap of the pure ones showing the possibility of an impurity based engineering of the photoluminescence properties of Si-nc.</jats:p> Simultaneously B- and P-doped silicon nanoclusters: Formation energies and electronic properties Applied Physics Letters |
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10.1063/1.2119424 |
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Applied Physics Letters |
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title |
Simultaneously B- and P-doped silicon nanoclusters: Formation energies and electronic properties |
title_unstemmed |
Simultaneously B- and P-doped silicon nanoclusters: Formation energies and electronic properties |
title_full |
Simultaneously B- and P-doped silicon nanoclusters: Formation energies and electronic properties |
title_fullStr |
Simultaneously B- and P-doped silicon nanoclusters: Formation energies and electronic properties |
title_full_unstemmed |
Simultaneously B- and P-doped silicon nanoclusters: Formation energies and electronic properties |
title_short |
Simultaneously B- and P-doped silicon nanoclusters: Formation energies and electronic properties |
title_sort |
simultaneously b- and p-doped silicon nanoclusters: formation energies and electronic properties |
topic |
Physics and Astronomy (miscellaneous) |
url |
http://dx.doi.org/10.1063/1.2119424 |
publishDate |
2005 |
physical |
|
description |
<jats:p>The effects of B and P codoping on the impurity formation energies and electronic properties of Si nanocrystals (Si-nc) are calculated by a first-principles method. We show that, if carriers in the Si-nc are perfectly compensated by simultaneous doping with n- and p-type impurities, the Si-nc undergo a minor structural distortion around the impurities and that the formation energies are always smaller than those for the corresponding single-doped cases. The band gap of the codoped Si-nc is strongly reduced with respect to the gap of the pure ones showing the possibility of an impurity based engineering of the photoluminescence properties of Si-nc.</jats:p> |
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author | Ossicini, S., Degoli, E., Iori, F., Luppi, E., Magri, R., Cantele, G., Trani, F., Ninno, D. |
author_facet | Ossicini, S., Degoli, E., Iori, F., Luppi, E., Magri, R., Cantele, G., Trani, F., Ninno, D., Ossicini, S., Degoli, E., Iori, F., Luppi, E., Magri, R., Cantele, G., Trani, F., Ninno, D. |
author_sort | ossicini, s. |
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container_title | Applied Physics Letters |
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description | <jats:p>The effects of B and P codoping on the impurity formation energies and electronic properties of Si nanocrystals (Si-nc) are calculated by a first-principles method. We show that, if carriers in the Si-nc are perfectly compensated by simultaneous doping with n- and p-type impurities, the Si-nc undergo a minor structural distortion around the impurities and that the formation energies are always smaller than those for the corresponding single-doped cases. The band gap of the codoped Si-nc is strongly reduced with respect to the gap of the pure ones showing the possibility of an impurity based engineering of the photoluminescence properties of Si-nc.</jats:p> |
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institution | DE-D275, DE-Bn3, DE-Brt1, DE-D161, DE-Zi4, DE-Gla1, DE-15, DE-Pl11, DE-Rs1, DE-14, DE-105, DE-Ch1, DE-L229 |
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spelling | Ossicini, S. Degoli, E. Iori, F. Luppi, E. Magri, R. Cantele, G. Trani, F. Ninno, D. 0003-6951 1077-3118 AIP Publishing Physics and Astronomy (miscellaneous) http://dx.doi.org/10.1063/1.2119424 <jats:p>The effects of B and P codoping on the impurity formation energies and electronic properties of Si nanocrystals (Si-nc) are calculated by a first-principles method. We show that, if carriers in the Si-nc are perfectly compensated by simultaneous doping with n- and p-type impurities, the Si-nc undergo a minor structural distortion around the impurities and that the formation energies are always smaller than those for the corresponding single-doped cases. The band gap of the codoped Si-nc is strongly reduced with respect to the gap of the pure ones showing the possibility of an impurity based engineering of the photoluminescence properties of Si-nc.</jats:p> Simultaneously B- and P-doped silicon nanoclusters: Formation energies and electronic properties Applied Physics Letters |
spellingShingle | Ossicini, S., Degoli, E., Iori, F., Luppi, E., Magri, R., Cantele, G., Trani, F., Ninno, D., Applied Physics Letters, Simultaneously B- and P-doped silicon nanoclusters: Formation energies and electronic properties, Physics and Astronomy (miscellaneous) |
title | Simultaneously B- and P-doped silicon nanoclusters: Formation energies and electronic properties |
title_full | Simultaneously B- and P-doped silicon nanoclusters: Formation energies and electronic properties |
title_fullStr | Simultaneously B- and P-doped silicon nanoclusters: Formation energies and electronic properties |
title_full_unstemmed | Simultaneously B- and P-doped silicon nanoclusters: Formation energies and electronic properties |
title_short | Simultaneously B- and P-doped silicon nanoclusters: Formation energies and electronic properties |
title_sort | simultaneously b- and p-doped silicon nanoclusters: formation energies and electronic properties |
title_unstemmed | Simultaneously B- and P-doped silicon nanoclusters: Formation energies and electronic properties |
topic | Physics and Astronomy (miscellaneous) |
url | http://dx.doi.org/10.1063/1.2119424 |