Monday, April 21, 2014

Periodic DFT+D Molecular Modeling of the Zn-MOF-5(100)/(110)TiO2 Interface: Electronic Structure, Chemical Bonding, Adhesion, and Strain

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The Journal of Physical Chemistry C

DOI: 10.1021/jp412756a




Filip Zasada, Witold Piskorz, Joanna Gryboś and Zbigniew Sojka

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