Functional Supramolecular Systems (IUAP No. P7/5) – Modeling the nonlinear optical properties of functionalized surfaced and complex systems

Project: PHD

Status	Finished
Effective start/end date	1/06/12 → 31/12/13

Assigning the stereochemistry of syn and anti β-trimethylsiloxy-α-trimethylsilyl alkanoic acid silyl esters using GIAO ¹H NMR chemical shift calculations
Hadj Mohamed, S., Trabelsi, M. & Champagne, B., 5 Aug 2017, In: Journal of molecular structure. 1141, p. 436-440 5 p.
Research output: Contribution to journal › Article › peer-review
A theoretical study on quasi-one-dimensional open-shell singlet ladder oligomers: multi-radical nature, aromaticity and second hyperpolarizability
Fukuda, K., Fujiyoshi, J. Y., Matsui, H., Nagami, T., Takamuku, S., Kitagawa, Y., Champagne, B. & Nakano, M., 1 May 2017, In: Organic Chemistry Frontiers. 4, 5, p. 779-789 11 p.
Research output: Contribution to journal › Article › peer-review
Diradical and Ionic Characters of Open-Shell Singlet Molecular Systems
Nakano, M., Fukuda, K., Ito, S., Matsui, H., Nagami, T., Takamuku, S., Kitagawa, Y. & Champagne, B., 2017, In: Journal of physical chemistry A. 121, 4, p. 861-873 13 p.
Research output: Contribution to journal › Article › peer-review

Project Details