@article{paperid:1080299,
author = {SAYYAR, ZAHRA and Vakili, Mohamad and ایوب کنعانی and Eshghi, Hossein},
title = {First-principles study of 2,6-dimethyl-3,5-heptanedione: a β-diketone molecular switch induced by hydrogen transfer},
journal = {Journal of Computational Electronics},
year = {2020},
volume = {19},
number = {3},
month = {September},
issn = {1569-8025},
pages = {917--930},
			numpages = {13},
keywords = {Electronic transport; DFT–NEGF; β-Diketone; Hydrogen transfer},
}