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cond-mat.mtrl-sci2018★ 20 cited
Emergence of hidden phases of methylammonium lead-iodide (CHNHPbI) upon compression
José A. Flores-Livas, Daniele Tomerini, Maximilian Amsler +3
We perform a thorough structural search with the minima hopping method (MHM) to explore low-energy structures of methylammonium lead iodide. By combining the MHM with a forcefield,…
cond-mat.mtrl-sci2018
Comment on the stability of decorated C 48 B 12 heterofullerene
Deb Sankar De, Santanu Saha, Luigi Genovese +1
A good hydrogen storage material should adsorb hydrogen in high concentrations and with optimal binding energies. Numerous mixed carbon boron fullerenes which are decorated with me…