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ncpchem:chiral_field

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Both sides previous revision Previous revision
ncpchem:chiral_field [2025/06/10 10:28]
47.128.111.55 old revision restored (2024/12/06 14:06)
ncpchem:chiral_field [2025/06/11 17:20] (current)
47.128.125.250 old revision restored (2024/12/04 18:54)
Line 67: Line 67:
 </WRAP> </WRAP>
 <WRAP column 500px> <WRAP column 500px>
-r(C-Br): 1.945 Å\\  
-r(C-Cl): 1.766 Å\\  
-r(C-H):  1.087 Å\\  
 Total E<sub>PV</sub> = 1.001E-18 au\\  Total E<sub>PV</sub> = 1.001E-18 au\\ 
 Central carbon: 5.523E-20 au\\  Central carbon: 5.523E-20 au\\ 
Line 99: Line 96:
 </WRAP> </WRAP>
 <WRAP column 500px> <WRAP column 500px>
- 
-r(C-Br): 4.469 Å\\  
-r(C-Cl): 4.316 Å\\  
-r(C-H):  3.744 Å\\  
 Total E<sub>PV</sub> = 1.629E-20 au\\  Total E<sub>PV</sub> = 1.629E-20 au\\ 
 Central carbon: 2.905E-23 au\\  Central carbon: 2.905E-23 au\\ 
ncpchem/chiral_field.txt · Last modified: 2025/06/11 17:20 by 47.128.125.250