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Questions related from Rana Khalid
Dear Amber + G09 Users I use this command to prepare the .com input file for g09 antechamber -i name.pdb -fi pdb -o bay.com -fo gcrt for optimization this basis set and theory use in the route...
09 September 2017 9,692 2 View
I want to do geometry optimization. Can anyone guide me how i can sort out this issue Using GEDIIS/GDIIS optimizer. Bend failed for angle 20 - 88 - 57 Tors failed for dihedral 37 - ...
07 July 2017 1,203 0 View
