Reply to "comment on 'origin of the nonplanarity of tetrafluoro cyclobutadiene, C4F4'"

Journal of Physical Chemistry A

Volumn 111, Issue 23, 2007, Pages 5119-5121

  Seal, Prasenjit ^a   Chakrabarti, Swapan ^a  

^a UNIVERSITY OF CALCUTTA   (India)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 34347358493     PISSN: 10895639     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp0711141     Document Type: Note

References (21)

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18. The laplacian of the electron density is calculated using the keyword cube = laplacian.
19. The kinetic energy and the nucleus-electron interaction energy are calculated using extralinks = 1608 in the MP2 technique.
20. The net magnetic susceptibility is calculated using the keyword nmr = giao with iop(10/6 = 1).
21. Rehaman, A.; Datta, A.; Mallajosyula, S. S.; Pati, S. K. J. Chem. Theory Comput. 2006, 2, 30-36.