Interface engineering with porous graphene as deposition regulator of stable Zn metal anode for long-life Zn-ion capacitor

Generalized Gradient Approximation Made Simple

John P. Perdew, Kieron Burke, Matthias Ernzerhof · Physical Review Letters · 1996 · 211.5K citations · Full text

Natural Sciences, Chemistry, Physics +16

A consistent and accurate<i>ab initio</i>parametrization of density functional dispersion correction (DFT-D) for the 94 elements H-Pu

Stefan Grimme, Jens Antony, Stephan Ehrlich et al. · The Journal of Chemical Physics · 2010 · 56.9K citations

Natural Sciences, Chemistry, Physics +14

From molecules to solids with the DMol3 approach

B. Delley · The Journal of Chemical Physics · 2000 · 10.9K citations · Full text

Natural Sciences, Chemistry, Physics +12

New Basis Set Exchange: An Open, Up-to-Date Resource for the Molecular Sciences Community

Benjamin P. Pritchard, Doaa Altarawy, Brett Didier et al. · Journal of Chemical Information and Modeling · 2019 · 2.3K citations

Natural Sciences, Chemistry, Computational Chemistry +9

Long-life and deeply rechargeable aqueous Zn anodes enabled by a multifunctional brightener-inspired interphase

Zhiming Zhao, Jingwen Zhao, Zhenglin Hu et al. · Energy & Environmental Science · 2019 · 2K citations

Natural Sciences, Materials Engineering, Materials Science +17