Sentence examples for computational detail from inspiring English sources
Perhaps, indeed, this is may be all any account short on biological or computational detail, and on the functional insight these offer, can provide.
Taking the –(CH2 6– as the backbone, we performed the rough calculations (see computational detail in Additional file 1) to investigate the frontier molecular orbitals of complexes with four Au atoms at the both ends, including 1,6-hexanedithiol (C6DT), 1,6-hexanediamineb (C6DA), 1,6-hexanedicarboxylic acid (C6DC), and 1,6-hexanediiodo (C6DI).
This file contains detailed descriptions of the methods and associated computational details. (PDF 251 kb) Additional file 2 Regularization tuning methods.
A detailed description of the EEM Cover approach is given in the Computational details section of the Additional file 1.
The all-important computational details were not provided, and I have little confidence that computations were carried out correctly, whatever "correctly" means.
A detailed description of the EEM Cutoff approach is given in the Computational details section of the Additional file 1.
The computational details were described earlier in this article.
In the next section, the computational details are discussed.
Additional file 1: Two-dimensional conductance histograms of molecular junctions and computational details. (DOCX 173 kb).
Each crystal structure was first fully geometry optimised, as described in the computational details section.
The computational details are similar to previous works in [4, 5, 10, 14].
