Sage Journals: Discover world-class research

Retricted access

Research article

First published 2010-5

Enhanced first hyperpolarizability of donor-acceptor diethynylsilane oligomers

R.A. Brennand, A.E. de A. Machado

Journal of Computational Methods in Sciences and Engineering

Retricted access

Research article

First published 2004-8

Electronic and vibrational polarizability and first hyperpolarizability of charge transfer chromophores: Quantum chemistry investigation

Amar Saal, Ourida Ouamerali

Journal of Computational Methods in Sciences and Engineering

Free access

Research article

First published 2004-9

Syntheses of NLO diamino chromophores containing imidazole and thiophene rings as conjugation linkage

Wei Wu, Zhaoli Zhang, Xiaoyun Zhang

Journal of Chemical Research

Retricted access

Research article

First published 2008-7

First hyperpolarizability of donor-acceptor substituted aromatic backbone molecular systems: Effect of dihedral angle and excitation energy

Diksha Makwani, R. Vijaya

Journal of Computational Methods in Sciences and Engineering

Retricted access

Research article

First published 2004-8

First hyperpolarizability of 6-vertex carboranes 2. DFT study of NH 2 /NO 2 -substituted 1,2-closo-dicarbahexaboranes

Kyrill Yu Suponitsky, Tatiana V. Timofeeva

Journal of Computational Methods in Sciences and Engineering

Retricted access

Research article

First published 2008-7

Vibrational versus electronic isotropic polarizability and first hyperpolarizability of a series of cis – Ru (II) – bipyridine complexes: A non-empirical investigation

Maammar Rekhis, Amar Saal, Carlo Adamo [...]

Journal of Computational Methods in Sciences and Engineering

Retricted access

Research article

First published 2004-8

Rational Design of atomic gaussian basis sets for Ab initio calculations of the dipole polarizabilities and hyperpolarizabilities. I. Optimized polarization sets for the first-row atoms from B to F

Mikhail B. Zuev, Sergey E. Nefediev

Journal of Computational Methods in Sciences and Engineering

Free access

Research article

First published 2001-10

Synthesis and second-order optical nonlinearity of carbazolyl-substituted furan chromophores with high thermal stability and good transparency †

Jianli Hua, Wei Zhang, Jingdong Luo [...]

Journal of Chemical Research

Retricted access

Research article

First published 2004-8

Rational Design of atomic Gaussian basis sets for Ab initio Calculations of the dipole polarizabilities and hyperpolarizabilities II. Moderate Size Basis Sets for the First-Row Atoms from B to F

Mikhail B. Zuev, Marina Yu. Balakina, Sergey E. Nefediev

Journal of Computational Methods in Sciences and Engineering

Retricted access

Research article

First published 2004-8

First-principle study on polarizability and hyperpolarizability of a transition metal cluster,[Mo 2 S 3 (C 6 H 11 ) 3 (CO) 6 ]·N(C 2 H 3 ) 4

Kechen Wu, Ping Liu, Zhangfeng Zhou [...]

Journal of Computational Methods in Sciences and Engineering

Search results