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Monica Vasiliu

Researcher at University of Alabama

Publications -  118
Citations -  2558

Monica Vasiliu is an academic researcher from University of Alabama. The author has contributed to research in topics: Chemistry & Density functional theory. The author has an hindex of 25, co-authored 105 publications receiving 1997 citations. Previous affiliations of Monica Vasiliu include Los Alamos National Laboratory & Argonne National Laboratory.

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Regeneration of Ammonia Borane Spent Fuel by Direct Reaction with Hydrazine and Liquid Ammonia

TL;DR: It is demonstrated that the spent fuel type derived from the removal of greater than two equivalents of H2 per molecule of AB can be converted back to AB nearly quantitatively by 24-hour treatment with hydrazine in liquid ammonia at 40°C in a sealed pressure vessel.
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Thorium(IV) molecular clusters with a hexanuclear Th core.

TL;DR: Three polynuclear thorium(IV) molecular complexes have been synthesized under ambient conditions from reactions of an amorphous Th precipitate, obtained via hydrolysis, with carboxylate functionalized ligands using R-COO(-) ligands to form discrete, neutral molecular clusters.
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Prediction of Bond Dissociation Energies/Heats of Formation for Diatomic Transition Metal Compounds: CCSD(T) Works.

TL;DR: Calculated bond dissociation energies as well as the heats of formation for those diatomics have been calculated by the Feller-Peterson-Dixon approach at the CCSD(T)/complete basis set (CBS) level of theory including scalar relativistic corrections and correlation of the outer shell of core electrons in addition to the valence electrons.