Concepedia

Computational catalysis for metal-organic frameworks: An overview

Gavin A. McCarver, Thayalan Rajeshkumar, Konstantinos D. Vogiatzis

Coordination Chemistry Reviews · 2021 · 67 citations · 141 references

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141

The M06 suite of density functionals for main group thermochemistry, thermochemical kinetics, noncovalent interactions, excited states, and transition elements: two new functionals and systematic testing of four M06-class functionals and 12 other functionals

Yan Zhao, Donald G. Truhlar · Theoretical Chemistry Accounts · 2007 · 30K citations · Full text

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Ror2 signaling regulates Golgi structure and transport through IFT20 for tumor invasiveness

Michiru Nishita, Seung‐Yeol Park, Tadashi Nishio et al. · Scientific Reports · 2017 · 16.1K citations · Full text

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A fifth-order perturbation comparison of electron correlation theories

Krishnan Raghavachari, Gary W. Trucks, John A. Pople et al. · Chemical Physics Letters · 1989 · 8.5K citations

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A Chemically Functionalizable Nanoporous Material [Cu <sub>3</sub> (TMA) <sub>2</sub> (H <sub>2</sub> O) <sub>3</sub> ] <sub> <i>n</i> </sub>

S.S.-Y. Chui, S.M.F. Lo, J.P.H. Charmant et al. · Science · 1999 · 6K citations

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How a century of ammonia synthesis changed the world

Jan Willem Erisman, Mark A. Sutton, James N. Galloway et al. · Nature Geoscience · 2008 · 4.5K citations

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