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A. Starobrat

2 papers here

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  • cond-mat.mtrl-sci2

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most citedThe ground state and polymorphism of LiSc(BH4)4 finally understood by Density Functional Theory modelling

1 citations · 1 across the 1 of their papers we have counts for

collaborators

2 papers

cond-mat.mtrl-sci2020

Metal (boro-) hydrides for high energy density storage and relevant emerging technologies

L. J. Bannenberg, M. Heere, H. Benzidi +23

The current energy transition imposes a rapid implementation of energy storage systems with high energy density and eminent regeneration and cycling efficiency. Metal hydrides are…

cond-mat.mtrl-sci2020★ 1 cited

The ground state and polymorphism of LiSc(BH4)4 finally understood by Density Functional Theory modelling

Agnieszka Starobrat, Mariana Derzsi, Tomasz Jaroń +2

We report a new metastable gamma polymorph of mixed metal borohydride LiSc(BH4)4. Using Density Functional Theory calculations with dispersion corrections, we prove importance of v…

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