| Tunable mechanochemistry of lithium battery electrodes N Muralidharan, CN Brock, AP Cohn, D Schauben, RE Carter, L Oakes, ... ACS nano 11 (6), 6243-6251, 2017 | 96 | 2017 |
| Implications of the method on polaron properties in energy materials Z Wang, C Brock, A Matt, KH Bevan Physical Review B 96 (12), 125150, 2017 | 51 | 2017 |
| Automated generation of highly accurate, efficient and transferable pseudopotentials RA Hansel, CN Brock, BC Paikoff, AR Tackett, DG Walker Computer Physics Communications 196, 267-275, 2015 | 19 | 2015 |
| Force-based optimization of pseudopotentials for non-equilibrium configurations CN Brock, BC Paikoff, I Muhammad, AR Tackett, DG Walker Computer Physics Communications 201, 106-118, 2016 | 7 | 2016 |
| Low-valency gallium PAW for faster defect calculations in GaN using plane wave DFT CN Brock, BB Baer, DG Walker Computational Materials Science 187, 110106, 2021 | 6 | 2021 |
| Metric based on the arctangents of the logderivatives for evaluating scattering properties of pseudopotentials CN Brock, AR Tackett, DG Walker Computer Physics Communications 247, 106929, 2020 | 2 | 2020 |
| The diatonic harmonica, pipe resonators, and the siren CN Brock, JP Cottingham The Journal of the Acoustical Society of America 130 (4_Supplement), 2343-2343, 2011 | 1 | 2011 |
| Robust and effective ab initio molecular dynamics simulations on the GPU cloud infrastructure using the Schrödinger Materials Science Suite A Fonari, G Agarwal, SC Tiwari, CN Brock, J Gavartin, MD Halls Computational Materials Science 244, 113188, 2024 | | 2024 |
| Insights into Electrolyte Reactivity and Solid Electrolyte Interphase Formation at the Li Metal Anode Surface from DFT Simulations G Agarwal, CN Brock, KK Rao, A Fonari, S Tiwari, JL Gavartin, HS Kwak, ... Electrochemical Society Meeting Abstracts 243, 2889-2889, 2023 | | 2023 |
| Automated Optimization of Pseudopotentials for Faster and More Accurate Plane Wave Density Functional Theory Calculations in Materials CN Brock Vanderbilt University, 2019 | | 2019 |
| Optimization of low-valence Ga PAWs for faster DFT calculations of point defects in GaN. CN Brock, AF Wright, DG Walker Sandia National Lab.(SNL-NM), Albuquerque, NM (United States), 2018 | | 2018 |
| SENSITIVITY OF THERMAL CONDUCTIVITY CALCULATIONS IN SILICON TO ERRORS IN INTERATOMIC FORCES CN Brock, MD Gerboth, M Fields, DG Walker ASTFE Digital Library, 2018 | | 2018 |
| Strain Engineering to Control the Electrochemistry of Battery Electrodes N Muralidharan, C Brock, G Walker, CL Pint Electrochemical Society Meeting Abstracts 231, 321-321, 2017 | | 2017 |
| Analytic Models for Temperature Distribution Near a Nanoantenna CN Brock, G Walker, Z Coppens Heat Transfer Summer Conference 55478, V001T03A011, 2013 | | 2013 |
