Modeling the interactions between polyoxometalates and their environment


Modeling the interactions between polyoxometalates and their environment is a scholarly work, published in 2011 in ''Journal of Computational Chemistry''. The main subjects of the publication include scaling, chemical physics, charge, actinide chemistry, polyoxometalate, Van der Waals' force, metal-organic framework, computational chemistry, partial charge, chemistry, field, density functional theory, and force field. Results are promising in terms of structural accuracy.

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