https://www.selleckchem.com/pr....oducts/abbv-cls-484.
These results support the bifunctional mechanism as a means to break the linear scaling relationship and to further reduce the overpotential of the OER.It is shown how the electronic equations of motion in extended Lagrangian Born-Oppenheimer molecular dynamics simulations [A. M. N. Niklasson, Phys. Rev. Lett. 100, 123004 (2008); J. Chem. Phys. 147, 054103 (2017)] can be integrated using low-rank approximations of the inverse Jacobian kernel. This kernel determines the metric tensor in the harmonic oscillator extension of the Lagra
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