Molecular hydrogen uptake by zigzag graphene nanoribbons doped with early 3d transition-metal atoms von Lebon, A., Carrete, J., Longo, R.C., Vega, A., Gallego, L.J.

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Influence of the exchange-correlation potential on the electrochemical properties of multicomponent silicate cathode materials von Longo, R.C., Xiong, K., Wang, W., Cho, K.

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Magnetic Cooperative Effects in Small Ni–Ru Clusters von Aguilera-Granja, F, Longo, R. C, Gallego, L. J, Vega, A

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Electronic properties of pure and p-type doped hexagonal sheets and zigzag nanoribbons of InP von Longo, R C, Carrete, J, Alemany, M M G, Gallego, L J

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Magnetic nanostructures stabilized by surface-state electrons von STEPANYUK, V. S, NIEBERGALL, L, LONGO, R. C, HERGERT, W, BRUNO, P

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Phase stability of Li-Mn-O oxides as cathode materials for Li-ion batteries: insights from ab initio calculations von Longo, R C, Kong, F T, KC, Santosh, Park, M S, Yoon, J, Yeon, D-H, Park, J-H, Doo, S-G, Cho, K

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Toward Selective Ultra-High-Vacuum Atomic Layer Deposition of Metal Oxides on Si(100) von Dick, Don, Ballard, Joshua B, Longo, R. C, Randall, John N, Cho, Kyeongjae, Chabal, Yves J

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Magnetism of substitutional Fe impurities in graphene nanoribbons von Longo, R. C., Carrete, J., Gallego, L. J.

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Engineering the magnetic structure of Fe clusters by Mn alloying von Longo, R C, Alemany, M M G, Vega, A, Ferrer, J, Gallego, L J

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Crystal structure and multicomponent effects in Tetrahedral Silicate Cathode Materials for Rechargeable Li-ion Batteries von Longo, R.C., Xiong, K., KC, Santosh, Cho, K.

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Elastic adsorbate interactions at the mesoscale von Longo, R C, Stepanyuk, V S, Kirschner, J

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Toward Atomic-Scale Patterned Atomic Layer Deposition: Reactions of Al2O3 Precursors on a Si(001) Surface with Mixed Functionalizations von Longo, R. C, Owen, J. H. G, McDonnell, S, Dick, D, Ballard, J. B, Randall, J. N, Wallace, R. M, Chabal, Y. J, Cho, K

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Structural and electronic properties of zigzag InP nanoribbons with Stone-Wales type defects von Longo, R C, Carrete, J, Varela, L M, Gallego, L J

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Behavior of Li defects in solid electrolyte lithium thiophosphate Li7P3S11: A first principles study von Xiong, K., Longo, R.C., KC, Santosh, Wang, W., Cho, Kyeongjae

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Interfacial bonding and electronic structure of HfO2/GaSb interfaces: A first principles study von Xiong, K., Wang, W., Zhernokletov, D. M., K. C., Santosh, Longo, R. C., Wallace, R. M., Cho, K.

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Enhancement of the thermoelectric efficiency of PbTe by selective site doping: Effect of group VA impurities von Xiong, K., Longo, R.C., Wang, W., Gupta, R.P., Gnade, B.E., Cho, K.

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Prediction of phonon thermal transport in thin GaAs, InAs and InP nanowires by molecular dynamics simulations: influence of the interatomic potential von Carrete, J, Longo, R C, Gallego, L J

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Noncollinear magnetic order in the six-atom Mn cluster von Longo, R C, Noya, E G, Gallego, L J

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Adatom self-organization induced by quantum confinement of surface electrons von Stepanyuk, V S, Negulyaev, N N, Niebergall, L, Longo, R C, Bruno, P

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Ab Initio Study of H2 Associative Desorption on Ad-Dimer Reconstructed Si(001) and Ge(001)-(2×1) Surfaces von Longo, R. C, Owen, J. H. G, McDonnell, S, Ballard, J. B, Wallace, R. M, Randall, J. N, Chabal, Y. J, Cho, K

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