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Entropy and Metal-Insulator Transition in Atomic-Scale Wires: The Case of In-Si(111)(4×1)/(8×2)., , , , , , , and . High Performance Computing in Science and Engineering, Springer, (2011)The Cu2O2 torture track for a real-life system: Cu2(btmgp)2O22+ oxo and peroxo species in density functional calculations., , , , and . J. Comput. Chem., 36 (22): 1672-1685 (2015)Geometrical and optical benchmarking of copper(II) guanidine-quinoline complexes: Insights from TD-DFT and many-body perturbation theory (part II)., , , , , and . J. Comput. Chem., 35 (29): 2146-2161 (2014)Polarization Dependent Water Adsorption on the Lithium Niobate Z-Cut Surfaces., , , , , , , , , and 1 other author(s). High Performance Computing in Science and Engineering, Springer, (2013)Geometrical and optical benchmarking of copper guanidine-quinoline complexes: Insights from TD-DFT and many-body perturbation theory., , , and . J. Comput. Chem., 35 (1): 1-17 (2014)Bis-μ-oxo and μ-η2: η2-peroxo dicopper complexes studied within (time-dependent) density-functional and many-body perturbation theory., , , and . J. Comput. Chem., 34 (12): 1035-1045 (2013)Copper Substrate Catalyzes Tetraazaperopyrene Polymerization., , , , , , , , and . High Performance Computing in Science and Engineering, Springer, (2011)Corrigendum: Geometrical and optical benchmarking of copper(II) guanidine-quinoline complexes: Insights from TD-DFT and many-body perturbation theory (Part II)., , , , , and . J. Comput. Chem., 36 (4): 272 (2015)Cu6(NGuaS)62+ and its oxidized and reduced derivatives: Confining electrons on a torus., , , , , and . J. Comput. Chem., 38 (20): 1752-1761 (2017)Model Predictive Interaction Control for Force Closure Grasping., , , and . CDC, page 1018-1023. IEEE, (2021)