PdnAg(4-n) and PdnPt(4-n) clusters on MgO (100): A density functional surface genetic algorithm investigation

Nanoscale , 2014, Accepted Manuscript

DOI: 10.1039/C4NR03363A, Paper

Christopher James Heard, Sven Heiles, Stefan Vajda, Roy L Johnston

The novel surface mode of the Birmingham Cluster Genetic Algorithm (S-BCGA) is employed for the global optimisation of noble metal tetramers upon an MgO(100) substrate at the GGA-DFT level of...

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