On the accuracy of the MB-pol many-body potential for water: Interaction energies, vibrational frequencies, and classical thermodynamic and dynamical properties from clusters … SK Reddy, SC Straight, P Bajaj, C Huy Pham, M Riera, DR Moberg, ... The Journal of chemical physics 145 (19), 2016 | 317 | 2016 |
Temperature-dependent vibrational spectra and structure of liquid water from classical and quantum simulations with the MB-pol potential energy function SK Reddy, DR Moberg, SC Straight, F Paesani The Journal of Chemical Physics 147 (24), 2017 | 119 | 2017 |
Molecular Origin of the Vibrational Structure of Ice Ih DR Moberg, SC Straight, C Knight, F Paesani The Journal of Physical Chemistry Letters 8 (12), 2579-2583, 2017 | 93 | 2017 |
Temperature dependence of the air/water interface revealed by polarization sensitive sum-frequency generation spectroscopy DR Moberg, SC Straight, F Paesani The Journal of Physical Chemistry B 122 (15), 4356-4365, 2018 | 84 | 2018 |
Exploring electrostatic effects on the hydrogen bond network of liquid water through many-body molecular dynamics SC Straight, F Paesani The Journal of Physical Chemistry B 120 (33), 8539-8546, 2016 | 49 | 2016 |
Troponins, intrinsic disorder, and cardiomyopathy I Na, MJ Kong, S Straight, JR Pinto, VN Uversky Biological chemistry 397 (8), 731-751, 2016 | 28 | 2016 |
Many-body potential energy surfaces with chemical and spectroscopic accuracy F Paesani, P Bajaj, M Riera, S Straight ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 252, 2016 | | 2016 |
Exploring the inhomogeneity of the hydrogen bond network in liquid water through many-body molecular dynamics S Straight, F Paesani ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 251, 2016 | | 2016 |