Skip to main content
. 2019 Jul 25;15(8):4497–4506. doi: 10.1021/acs.jctc.9b00529

Figure 7.

Figure 7

CPU time as a function of basis size for three primary steps in BE(5) calculations of the six polyacene chains in Figure 5. Times for the determination of both {λA} and μ are reported per BE iteration (ERI transform needs to be performed only once). Dashed lines are exponential fit, with the scalings indicated to the side.