Carte Calculations on nonlinear optical properties for large systems Yuriko Aoki

Calculations on nonlinear optical properties for large systems

The elongation method

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Legare: Carte broșată
Disponibilitate: În depozitul extern
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275.77 lei
For design purposes one needs to relate the structure of proposed materials to their NLO (nonlinear...

Informații despre carte

Limbă
engleză
Legare
Carte - Carte broșată
Publicat
2014
Pagini
93
EAN
9783319110677
ISBN
3319110675
Enbook ID
05185952
Greutate
2029
Dimensiuni
155 x 235 x 7

Descriere completă

For design purposes one needs to relate the structure of proposed materials to their NLO (nonlinear optical) and other properties, which is a situation where theoretical approaches can be very helpful in providing suggestions for candidate systems that subsequently can be synthesized and studied experimentally. This brief describes the quantum-mechanical treatment of the response to one or more external oscillating electric fields for molecular and macroscopic, crystalline systems. To calculate NLO properties of large systems, a linear scaling generalized elongation method for the efficient and accurate calculation is introduced. The reader should be aware that this treatment is particularly feasible for complicated three-dimensional and/or delocalized systems that are intractable when applied to conventional or other linear scaling methods.§

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