Paulo Siani

activity

20202026

most citedMolecular dynamics simulations of cRGD-conjugated PEGylated TiO

_{2}

nanoparticles for targeted photodynamic therapy

27 citations · 60 across the 6 of their papers we have counts for

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cond-mat.mtrl-sci2020★ 19 cited

Insight into the interface between Fe $_{3}$ O $_{4}$ (001) surface and water overlayers through multiscale molecular dynamics simulations

Hongsheng Liu, Enrico Bianchetti, Paulo Siani +1

In this work we investigate the Fe $_{3}$ O $_{4}$ (001) surface/water interface by combining several theoretical approaches, ranging from a hybrid functional method (HSE06) to density-fun…

Insight into the interface between Fe3​O4​(001) surface and water overlayers through multiscale molecular dynamics simulations

Insight into the interface between Fe $_{3}$ O $_{4}$ (001) surface and water overlayers through multiscale molecular dynamics simulations