A coarse-grained model for the mechanical behavior of multi-layer graphene L Ruiz, W Xia, Z Meng, S Keten Carbon 82, 103-115, 2015 | 198 | 2015 |
Computational optimization of electric fields for better catalysis design VV Welborn, L Ruiz Pestana, T Head-Gordon Nature Catalysis 1 (9), 649-655, 2018 | 171 | 2018 |
Processable cyclic peptide nanotubes with tunable interiors R Hourani, C Zhang, R Van Der Weegen, L Ruiz, C Li, S Keten, BA Helms, ... Journal of the American Chemical Society 133 (39), 15296-15299, 2011 | 143 | 2011 |
Recoverable slippage mechanism in multilayer graphene leads to repeatable energy dissipation X Wei, Z Meng, L Ruiz, W Xia, C Lee, JW Kysar, JC Hone, S Keten, ... ACS nano 10 (2), 1820-1828, 2016 | 139 | 2016 |
Ab initio molecular dynamics simulations of liquid water using high quality meta-GGA functionals LR Pestana, N Mardirossian, M Head-Gordon, T Head-Gordon Chemical science 8 (5), 3554-3565, 2017 | 124 | 2017 |
Use of the rVV10 nonlocal correlation functional in the B97M-V density functional: Defining B97M-rV and related functionals N Mardirossian, L Ruiz Pestana, JC Womack, CK Skylaris, ... The journal of physical chemistry letters 8 (1), 35-40, 2017 | 105 | 2017 |
The quest for accurate liquid water properties from first principles L Ruiz Pestana, O Marsalek, TE Markland, T Head-Gordon The journal of physical chemistry letters 9 (17), 5009-5016, 2018 | 92 | 2018 |
Dimensions of biological cellulose nanocrystals maximize fracture strength R Sinko, S Mishra, L Ruiz, N Brandis, S Keten ACS macro letters 3 (1), 64-69, 2014 | 74 | 2014 |
Critical length scales and strain localization govern the mechanical performance of multi-layer graphene assemblies W Xia, L Ruiz, NM Pugno, S Keten Nanoscale 8 (12), 6456-6462, 2016 | 71 | 2016 |
A coarse-grained model for the mechanical behavior of graphene oxide Z Meng, RA Soler-Crespo, W Xia, W Gao, L Ruiz, HD Espinosa, S Keten Carbon 117, 476-487, 2017 | 60 | 2017 |
Tailoring the water structure and transport in nanotubes with tunable interiors L Ruiz, Y Wu, S Keten Nanoscale 7 (1), 121-132, 2015 | 54 | 2015 |
Coexistence of multilayered phases of confined water: the importance of flexible confining surfaces L Ruiz Pestana, LE Felberg, T Head-Gordon ACS nano 12 (1), 448-454, 2018 | 51 | 2018 |
Direct exchange mechanism for interlayer ions in non-swelling clays L Ruiz Pestana, K Kolluri, T Head-Gordon, LN Lammers Environmental science & technology 51 (1), 393-400, 2017 | 41 | 2017 |
Diels–Alder reactions in water are determined by microsolvation LR Pestana, H Hao, T Head-Gordon Nano letters 20 (1), 606-611, 2019 | 36 | 2019 |
Persistence length and stochastic fragmentation of supramolecular nanotubes under mechanical force L Ruiz, P VonAchen, TD Lazzara, T Xu, S Keten Nanotechnology 24 (19), 195103, 2013 | 33 | 2013 |
Strong anisotropy in liquid water upon librational excitation using terahertz laser fields F Novelli, L Ruiz Pestana, KC Bennett, F Sebastiani, EM Adams, ... The Journal of Physical Chemistry B 124 (24), 4989-5001, 2020 | 31 | 2020 |
Directing the self-assembly of supra-biomolecular nanotubes using entropic forces L Ruiz, S Keten Soft Matter 10 (6), 851-861, 2014 | 23 | 2014 |
Regulating ion transport in peptide nanotubes by tailoring the nanotube lumen chemistry L Ruiz, A Benjamin, M Sullivan, S Keten The journal of physical chemistry letters 6 (9), 1514-1520, 2015 | 18 | 2015 |
A structural coarse-grained model for clays using simple iterative Boltzmann inversion K Schaettle, L Ruiz Pestana, T Head-Gordon, LN Lammers The Journal of chemical physics 148 (22), 2018 | 13 | 2018 |
Reaction kinetics of supplementary cementitious materials in reactivity tests S Ramanathan, LR Pestana, P Suraneni Cement 8, 100022, 2022 | 10 | 2022 |