Citing LModeA-nano
If you find LModeA-nano useful in your research, please support this project by citing the following paper in your publications/reports:
Tao, W. Zou, S. Nanayakkara, et al., LModeA-nano: A PyMOL Plugin for Calculating Bond Strength in Solids, Surfaces, and Molecules via Local Vibrational Mode Analysis, J. Chem. Theory Comput. 18, 1821 (2022)
@article{Tao2022,
year = {2022},
volume = {18},
number = {3},
pages = {1821--1837},
author = {Yunwen Tao and Wenli Zou and Sadisha Nanayakkara and Elfi Kraka},
title = {{LModeA}-nano: A {PyMOL} Plugin for Calculating Bond Strength in Solids, Surfaces, and Molecules via Local Vibrational Mode Analysis},
journal = {J. Chem. Theory Comput.}
}
Additional references include:
Tao, W. Zou, D Sethio, et al., In Situ Measure of Intrinsic Bond Strength in Crystalline Structures: Local Vibrational Mode Theory for Periodic Systems, J. Chem. Theory Comput. 15, 1761 (2019) 📎
Kraka, W. Zou, Y. Tao, Decoding Chemical Information from Vibrational Spectroscopy Data: Local Vibrational Mode Theory, WIREs: Comput. Mol. Sci. 10, e1480 (2020) 📎