𝔖 Bobbio Scriptorium
✦   LIBER   ✦

Silicon nanocrystals studied using Hartree–Fock and molecular dynamics

✍ Scribed by A.M Mazzone


Publisher
Elsevier Science
Year
2004
Tongue
English
Weight
166 KB
Volume
226
Category
Article
ISSN
0169-4332

No coin nor oath required. For personal study only.


📜 SIMILAR VOLUMES


Relativity and the chemistry of UF6: A m
✍ W. A. De Jong; W. C. Nieuwpoort 📂 Article 📅 1996 🏛 John Wiley and Sons 🌐 English ⚖ 986 KB

The electronic structure and bonding of UF, and UF; are studied within a relativistic framework using the MOLFDIR program package. A stronger bonding but more ionic molecule is found if one compares the relativistic with the nonrelativistic results. The first peak in the photoelectron spectrum of Ka

Theoretical probation of FClCO⋯Cl2 molec
✍ Andrzej Nowek; Shirisha Reddy; Jerzy Leszczyński 📂 Article 📅 1994 🏛 Elsevier Science 🌐 English ⚖ 502 KB

Potential energy surfaces of the weak FClCOX12 complex were studied using ab initio post Hartree-Fock theory at the MP2 and MP4 levels with 6-3 11 G(d) and 6-3 11 G (2d) basis sets. Two minimum energy conformations, first-order transition state and two second-order transition structures were found.

Spectral and dynamical study of nonlinea
✍ K. Žídek; F. Trojánek; B. Dzurňák; P. Malý; I. Pelant 📂 Article 📅 2009 🏛 Elsevier Science 🌐 English ⚖ 255 KB

We report on the spectral and dynamical properties of photoluminescence (PL) under ultrashort (femtosecond and picosecond) laser pulse excitation in Si nanocrystals prepared by Si + -ion implantation into a silica matrix. We concentrate on the luminescence properties that make it possible to disting