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Adhikari, K., Chakrabarty, A., Bouhali, O., Mousseau, N., Becquart, C., & El-Mellouhi, F. (2018). Benchmarking the performance of plane-wave vs. localized orbital basis set methods in DFT modeling of metal surface: a case study for Fe-(110). Journal of Computational Science, 29, 163-167. Lien externe
Becquart, C. S., Mousseau, N., & Domain, C. (2018). Atomistic Kinetic Monte Carlo and Solute Effects. Dans Andreoni, W., & Yip, S. (édit.), Handbook of Materials Modeling (p. 1-20). Lien externe
Dubois, M.-A., Bouju, X., & Rochefort, A. (2018). Toward interactive scanning tunneling microscopy simulations of large-scale molecular systems in real time. Journal of Applied Physics, 124(4), 044301 (10 pages). Lien externe
Henkelman, G., Jónsson, H., Lelièvre, T., Mousseau, N., & Voter, A. F. (2018). Long-Timescale Simulations: Challenges, Pitfalls, Best Practices, for Development and Applications. Dans Andreoni, W., & Yip, S. (édit.), Handbook of Materials Modeling : Methods, Theory and Modeling (10 pages). Lien externe
Mahmoud, S., & Mousseau, N. (2018). Long-time point defect diffusion in ordered nickel-based binary alloys: How small kinetic differences can lead to completely long-time structural evolution. Materialia, 4, 575-584. Lien externe
Masut, R. A. (2018). Incorporation of Si during vapor phase epitaxy of III-V compounds: evidence of an enthalpy-entropy compensation effect. Journal of Applied Physics, 124(9), 7 pages. Lien externe
Munshi, A. H., Kephart, J. M., Abbas, A., Danielson, A., Gélinas, G., Beaudry, J.-N., Barth, K. L., Walls, J. M., & Sampath, W. S. (2018). Effect of CdCl₂ passivation treatment on microstructure and performance of CdSeTe/CdTe thin-film photovoltaic devices. Solar Energy Materials and Solar Cells, 186, 259-265. Lien externe
Trochet, M., Mousseau, N., Béland, L. K., & Henkelman, G. (2018). Off-Lattice Kinetic Monte Carlo Methods. Dans Handbook of Materials Modeling (p. 1-29). Lien externe
Verdier, P., Vasilevskiy, D., Turenne, S., & Masut, R. A. (2018). Microstructure and Thermoelectric Properties of Hot Extruded Sb-Doped Mg₂Si Using MoS₂ Nano-particles as Lubricant. Journal of Electronic Materials, 47(11), 6833-6841. Lien externe
