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Now showing items 71-80 of 121
Effect of the Metal Substrate on Interlayer Interactions in Bilayer Graphene
(American Chemical Society, 2018)
Pressure-Induced Isostructural Antiferromagnetic-Ferromagnetic Transition in an Organic Electride
(American Chemical Society, 2018)
Theoretical Descriptors of Electrides
(American Chemical Society, 2018)
Non-Covalent Interactions in Molecular Crystals: Exploring the Accuracy of the Exchange-Hole Dipole Moment Model with Local Orbitals
(American Chemical Society, 2018)
The explicit examination of the magnetic states of electrides
(Royal Society of Chemistry, 2016)
Thermodynamic cycles of the alkali metal-ligand complexes central to electride formation
(Royal Society of Chemistry, 2017)
The ionic versus metallic nature of 2D electrides: A density-functional description
(Royal Society of Chemistry, 2017)
A computational exploration of the crystal energy and charge carrier mobility landscapes of the chiral [6]helicene molecule
(Royal Society of Chemistry, 2018)