International
Tables for
Crystallography
Volume B
Reciprocal space
Edited by U. Shmueli

© International Union of Crystallography 2006
International Tables for Crystallography (2006). Vol. B. ch. 3.4, p. 392

Table 3.4.12.4 

D. E. Williamsa‡

aDepartment of Chemistry, University of Louisville, Louisville, Kentucky 40292, USA

Table 3.4.12.4 | top | pdf |
The reciprocal-lattice results (kJ mol−1, Å) for the dispersion sum ([n = 6]) of crystalline benzene

Limit [w = 0.1] [w = 0.15] [w = 0.2] [w = 0.3] [w = 0.4]
0.0 −5.547 −16.706 −32.326 −43.681 80.947
0.3 0.000 −0.004 −0.321 −16.792 −117.106
0.4 0.000 −0.004 −0.324 −18.656 −152.651
0.5     −0.324 −18.716 −155.940
0.6       −18.719 −157.102
0.7       −18.719 −157.227
0.8         −157.233
0.9         −157.234
1.0         −157.234