Wednesday, March 04, 2015

A Stillinger-Weber Potential for Single-Layer Black Phosphorus, and the Importance of Cross-Pucker Interactions for Negative Poisson's Ratio and Edge Stress-Induced Bending

Nanoscale , 2015, Accepted Manuscript

DOI: 10.1039/C4NR07341J, Paper

Jin-Wu Jiang, Timon Rabczuk, Harold Park

The distinguishing structural feature of single-layer black phosphorus is its puckered structure, which leads to many novel physical properties. In this work, we first present a new parameterization of the...

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