Calculation of first and second static hyperpolarizabilities of one- to three-dimensional periodic compounds. Implementation in the CRYSTAL code.
Author:
Publisher
AIP Publishing
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Link
http://aip.scitation.org/doi/pdf/10.1063/1.3043366
Reference26 articles.
1. Abinitioanalytic polarizability, first and second hyperpolarizabilities of large conjugated organic molecules: Applications to polyenes C4H6to C22H24
2. Calculation of the polarizability and hyperpolarizabilities of periodic quasi-one-dimensional systems
3. From uncoupled to coupled Hartree–Fock polarizabilities of infinite polymeric chains. Pariser–Parr–Pople applications to the polyacetylene chains
4. Calculation of ab initio dynamic hyperpolarizabilities of polymers
5. An efficient finite field approach for calculating static electric polarizabilities of periodic systems
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