Chemical bonding motifs from a tiling of the many-electron wavefunction Y Liu, TJ Frankcombe, TW Schmidt Physical Chemistry Chemical Physics 18 (19), 13385-13394, 2016 | 35 | 2016 |
The electronic structure of benzene from a tiling of the correlated 126-dimensional wavefunction Y Liu, P Kilby, TJ Frankcombe, TW Schmidt Nature Communications 11 (1), 1210, 2020 | 33 | 2020 |
Calculating curly arrows from ab initio wavefunctions Y Liu, P Kilby, TJ Frankcombe, TW Schmidt Nature Communications 9 (1), 1436, 2018 | 25 | 2018 |
Triple-resonance spectroscopy reveals the excitation spectrum of very cold, isomer-specific protonated naphthalene O Krechkivska, Y Liu, KLK Lee, K Nauta, SH Kable, TW Schmidt The Journal of Physical Chemistry Letters 4 (21), 3728-3732, 2013 | 17 | 2013 |
Electronic transitions of molecules: vibrating Lewis structures Y Liu, P Kilby, TJ Frankcombe, TW Schmidt Chemical Science 10 (28), 6809-6814, 2019 | 14 | 2019 |
H and D Attachment to Naphthalene: Spectra and Thermochemistry of Cold Gas-Phase 1-C10H9 and 1-C10H8D Radicals and Cations O Krechkivska, CM Wilcox, B Chan, R Jacob, Y Liu, K Nauta, SH Kable, ... The Journal of Physical Chemistry A 119 (13), 3225-3232, 2015 | 11 | 2015 |
Visualizing the 30-dimensional antisymmetrized electronic structure of water: the emergence of lone pairs Y Liu, TJ Frankcombe, TW Schmidt The Journal of Physical Chemistry Letters 11 (3), 735-739, 2020 | 7 | 2020 |
Electronic wavefunction tiles Y Liu, TJ Frankcombe, TW Schmidt Australian Journal of Chemistry 73 (8), 757-766, 2020 | 6 | 2020 |
The Electronic Structure of Water: Pulling Rabbit-Ears out of a Wave Function Y Liu, TJ Frankcombe, T Schmidt | | 2019 |