Research Article
Prediction of the Linear and Nonlinear Optical Properties of a Schiff Base Derivatives via DFT
Table 4
DFT static results for the EPAF electrical parameters.
| ε | | | | μ (D) | 10−36esu | 10−30esu | 10−24esu |
| 1.000 | 170 | -0.230 | 42 | 2.86 | 1.430 | 220 | -0.200 | 44 | 3.01 | 1.911 | 254 | -0.157 | 46.4 | 3.12 | 2.374 | 280 | -0.127 | 47.7 | 3.19 | 4.711 | 351 | -0.611 | 51 | 3.44 | 5.697 | 367 | -0.581 | 51.7 | 3.48 | 7.426 | 387 | -0.602 | 52.6 | 3.53 | 8.930 | 399 | -0.602 | 53.1 | 3.57 | 10.125 | 406 | -0.603 | 53.4 | 3.59 | 12.470 | 416 | -0.595 | 53.9 | 3.61 | 17.332 | 435 | -0.605 | 54.7 | 3.67 | 20.493 | 440 | -0.607 | 54.9 | 3.68 | 24.852 | 446 | -0.609 | 55.2 | 3.70 | 32.613 | 448 | -0.609 | 55.3 | 3.70 | 35.688 | 452 | -0.609 | 55.5 | 3.72 | 46.826 | 454 | -0.608 | 55.6 | 3.72 | 51.100 | 458 | -0.612 | 55.6 | 3.73 | 78.355 | 461 | -0.604 | 55.9 | 3.74 | 108.940 | 464 | -0.604 | 56.0 | 3.75 |
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