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Oxidation free energies of some organic dyes, prototypical for applications in optoelectronic devices, have been computed at the DFT level by using different functionals.
After results have been computed at the RNA-Rocket site they can be streamed back to the respective BRC depending on the reference organism selected for analysis.
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However, the computed FS of 1.12 in Fig. 10a was computed at the middle of the dry season, with little or no water in the tailing slope.
Eigenvectors were computed at the same time.
The absorption spectra were computed at the TD-PBE0/6-31G* TD-PBE0/6-31G* TD-PBE0/6-31G*
Transmission eigenchannels were computed at the centre of the Brillouin zone49.
The output will be computed at the spectrum energies and weighted by the weights.
Changes in hydroperiod are computed at the pneumatophore level, initially set at 14 cm from the ground.
The most resilient controller is computed at the center of maximum-area inscribed rectangle.
The flux returned by eff2evt is computed at the exact energy in the event file (or the parameter file value).
Membrane potential will be computed at the ends of the section and the middle of each compartment.
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