@inproceedings {309,
	title = {Investigation of neutral B13 clusters: A density functional theory study},
	booktitle = {Proceedings of the 34th Samahang Pisika ng Pilipinas Physics Congress},
	year = {2016},
	month = {18{\textendash}21 Aug 2016},
	pages = {SPP-2016-PA-18},
	address = {University of the Philippines Visayas, Iloilo City},
	abstract = {We investigate the electronic structure of neutral boron_13 (B13) clusters using spin-polarized density functional theory (DFT). The stable B13 cluster is observed to have a two-dimensional planar structure. Energy levels diagram shows that it has a highest occupied molecular orbital{\textendash}lowest unoccupied molecular orbital (HOMO-LUMO) gap of 0.36 eV. Analysis of the electronic charge density of the B13 cluster reveals that most of the electrons are shared between B atoms and are located at the edges, where the HOMO and LUMO are also localized. Our results indicate that the most reactive part of the cluster is along its edges.},
	author = {Alexandra B. Santos-Putungan and Nata{\v s}a Stoji{\'c} and Nadia Binggeli and Francis N. C. Paraan}
}
