Ab initio investigation of α-and ζ-V2O5 for beyond lithium ion battery cathodes R Shepard, M Smeu Journal of Power Sources 472, 228096, 2020 | 22 | 2020 |
Ab initio investigation into the physisorption of noble gases on graphene R Shepard, S Shepard, M Smeu Surface Science 682, 38-42, 2019 | 15 | 2019 |
First principles investigation into the interwoven nature of voltage and mechanical properties of the LixNMC-811 cathode M Woodcox, R Shepard, M Smeu Journal of Power Sources 516, 230620, 2021 | 12 | 2021 |
Reaction Mechanism of Na-Ion Deintercalation in Na2CoSiO4 J Wang, G Hoteling, R Shepard, M Wahila, F Wang, M Smeu, H Liu The Journal of Physical Chemistry C 126 (40), 16983-16992, 2022 | 4 | 2022 |
2D Ni0. 25Mn0. 75O2: A high-performance cathode for multivalent ion batteries D Liepinya, R Shepard, M Smeu Computational Materials Science 202, 110948, 2022 | 4 | 2022 |
Ab initio determination of a simultaneous dual-ion charging mechanism for Ni 0.25 Mn 0.75 O 2 through redox reactions of Ni 2+/Ni 4+ and O 2−/O− R Shepard, S Brennan, TR Juran, J Young, M Smeu Journal of Materials Chemistry A 10 (36), 18916-18927, 2022 | 2 | 2022 |
A Computational Investigation of Cathode Materials for Next-Generation Secondary Batteries RA Shepard State University of New York at Binghamton, 2021 | 2 | 2021 |
Investigating the role of structural water on the electrochemical properties of α-V 2 O 5 through density functional theory K Sandagiripathira, MA Moghaddasi, R Shepard, M Smeu Physical Chemistry Chemical Physics 24 (39), 24271-24280, 2022 | 1 | 2022 |
Ab initio determination of a simultaneous dual-ion charging mechanism for Ni₀. ₂₅Mn₀. ₇₅O₂ through redox reactions of Ni²⁺/Ni⁴⁺ and O²⁻/O⁻ R Shepard, S Brennan, TR Juran, J Young, M Smeu | | 2022 |