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Solvent effects on molecular structure, vibrational frequencies, and NLO properties of N-(2, 3-dichlorophenyl)-2-nitrobenzene–sulfonamide: a density functional theory study

Chouaih, Abdelkader; Benhalima, Nadia; Boukabcha, Nourdine; Tamer, Ömer; Avcı, Davut; Atalay, Yusuf; Hamzaoui, Fodil (Brazilian Journal of Physics, 2016-08-01)

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Auteur
- Atalay, Yusuf (1)
- Avcı, Davut (1)
- Benhalima, Nadia (1)
- Boukabcha, Nourdine (1)
- Chouaih, Abdelkader (1)
- Hamzaoui, Fodil (1)
- Tamer, Ömer (1)
Sujet
- DFT (1)
- HOMO–LUMO (1)
- Molecular surfaces (1)
- Nonlinear optics (1)
- Vibration spectrum (1)
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Date Issued
- 2016 (1)