Bug reports and pull requests are welcome on GitHub athttps://github.com/[USERNAME]/glueby. This project is intended to be a safe, welcoming space for collaboration, and contributors are expected to adhere to thecode of conduct. License ...
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Figure 2. Band structures (left panel) and projected density of states (right panel) for the (a) rutile, (b) brookite, and (c) anatase polymorphs of TiO2, as obtained by DFT + U calculations (PBE functional, GBRV pseudopotentials, 𝑈=7.8 eVU=7.8 eV, 𝐽=1.0 eVJ=1.0 eV) in Qu...
Except got the usage of transition metal complexes mentioned above, there have been reports on using macrocyclic rings with nitrogen pockets with either Co or Fe as active catalysts for ORR. Ghosh et al. synthesized a Co (III) amido-macrocyclic complex along with graphene which displayed an ORR...
Bug reports and pull requests are welcome on GitHub at https://github.com/[USERNAME]/glueby. This project is intended to be a safe, welcoming space for collaboration, and contributors are expected to adhere to the code of conduct. License The gem is available as open source under the terms...