Home Symbol which looks like a small house Up Solid circle with an upward pointer in it

NOTICE: Due to scheduled maintenance at our Gaithersburg campus, this site will not be available from 5:00 pm EDT (21:00 UTC) on Friday October 25 until 5:00 pm (21:00 UTC) on Sunday October 27. We apologize for any inconvenience this outage may cause.

No Species Found

No species in the database contian data from the requested reference: Pople, J.A.; Schlegel, H.B.; Krishna, R.; DeFrees, D.J.; Binkley, J.S.; Frisch, M.J.; Whiteside, R.A.; Hout, R.F.; Hehre, W.J., Int. J. Quantum Chem., Quantum Chem. Symp., 1981, 15, 269.