The spectroscopic constants and charge distribution for the ground states of 36 diatomic molecules containing C to F and Si to C1 atoms have been studied with the deMon density functional program, using the local density approximation and large basis sets. For each species, we computed the energy an
✦ LIBER ✦
Local-density approximation study ofp-Si/n-Si nanoscale junctions
✍ Scribed by V.G. Zavodinsky; I.A. Kuyanov
- Publisher
- Elsevier Science
- Year
- 1996
- Tongue
- English
- Weight
- 245 KB
- Volume
- 20
- Category
- Article
- ISSN
- 0749-6036
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✦ Synopsis
We have performed a first-principles local-density cluster investigation of nanoscale p-Si/n-Si junctions. Al and P atoms were used as dopants and Al-P distances were of order a few A ˚ngstroms. The thermoemission current-voltage characteristics were calculated in addition to the electronic structure. It was shown that a rectifying nanoscale p-n junction can be formed in silicon if the distance between donor and acceptor atoms is not too small (about 1 nm).
📜 SIMILAR VOLUMES
Local density studies of diatomic AB mol
✍
Delano P. Chong
📂
Article
📅
1994
🏛
Elsevier Science
🌐
English
⚖ 358 KB