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Publications

Publications by Ismaila Dabo. Show all publications

D. A. Eichfeld, W. Chen, I. Dabo, B. M. Foley, and B. Ramos-Alvarado
Thermal rectification in thin film metalattice structures: A computational study
Journal of Applied Physics 133 (2023)
10.1063/5.0135963
K. A. Penrod, M. A. Burgess, D. Akbarian, I. Dabo, W. H. H. Woodward, and A. C. T. van Duin
Using C-DFT to develop an e-ReaxFF force field for acetophenone radical anion
The Journal of Chemical Physics 155 (2021)
10.1063/5.0064705
J. M. Goff, F. Marques dos Santos Vieira, N. D. Keilbart, Y. Okada, and I. Dabo
Predicting the Pseudocapacitive Windows for MXene Electrodes with Voltage-Dependent Cluster Expansion Models
ACS Applied Energy Materials 4 3151-3159 (2021)
10.1021/acsaem.0c02910
N. E. Kirchner-Hall, W. Zhao, Y. Xiong, I. Timrov, and I. Dabo
Extensive Benchmarking of DFT+U Calculations for Predicting Band Gaps
Applied Sciences 11 2395 (2021)
10.3390/app11052395
Y. Xiong, W. Chen, W. Guo, H. Wei, and I. Dabo
Data-driven analysis of the electronic-structure factors controlling the work functions of perovskite oxides
Physical Chemistry Chemical Physics 23 6880-6887 (2021)
10.1039/d0cp05595f
K. A. Cooley, N. Keilbart, J. G. Champlain, L. B. Ruppalt, T. N. Walter, I. Dabo, and S. E. Mohney
First-principles study and experimental characterization of metal incorporation in germanium telluride
Journal of Applied Physics 128 (2020)
10.1063/5.0029205
R. W. Lord, J. Fanghanel, C. F. Holder, I. Dabo, and R. E. Schaak
Colloidal Nanoparticles of a Metastable Copper Selenide Phase with Near-Infrared Plasmon Resonance
Chemistry of Materials 32 10227-10234 (2020)
10.1021/acs.chemmater.0c04058
C. F. Holder, J. Fanghanel, Y. Xiong, I. Dabo, and R. E. Schaak
Phase-Selective Solution Synthesis of Perovskite-Related Cesium Cadmium Chloride Nanoparticles
Inorganic Chemistry 59 11688-11694 (2020)
10.1021/acs.inorgchem.0c01574
R. Slapikas, I. Dabo, and S. B. Sinnott
Optimized utilization of COMB3 reactive potentials in LAMMPS
The Journal of Chemical Physics 152 (2020)
10.1063/5.0009011
J. M. Goff, S. B. Sinnott, and I. Dabo
Effects of surface charge and cluster size on the electrochemical dissolution of platinum nanoparticles using COMB3 and continuum electrolyte models
The Journal of Chemical Physics 152 (2020)
10.1063/1.5131720
Department of Energy
This work was supported by the U.S. Department of Energy, Office of Science, Office of Basic Energy Sciences. Any opinions, findings, and conclusions or recommendations expressed in this material are those of the author(s) and do not necessarily reflect the views of the Department of Energy.