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Frisch, M.J.; Trucks, G.W.; Schlegel, H.B.; Gill, P.M.W.; Johnson, B.G.; Robb, M.A.; Cheeseman, J.R.; Keith, T.; Petersson, G.A.; Montgomery, J.A.; Raghavachari, K.; Al-Laham, M.A.; Zakrzewski, V.G.; Ortiz, J.V.; Foresman, J.B.; Cioslowski, J.; Stefanov, B.B.; Nanayakkara, A.; Challacombe, M.; Peng, C.Y.; Ayala, P.Y.; Chen, W.; Wong, M.W.; Andres, J.L.; Replogle, E.S.; Gomperts, R.; Martin, R.L.; Fox, D.J.; Binkley, J.S.; Defrees, D.J.; Baker, J.; Stewart, J.P.; Head-Gordon, M.; Gonzalez, C.; Pople, J.A. Gaussian 94, revision x.x; Gaussian, Inc.: Pittsburgh, PA, 1995. The program provides statistical mechanical corrections as described in Statistical Mechanics by Donald A. McQuarrie (1976) page 138.
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Frisch, M.J.1
Trucks, G.W.2
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Petersson, G.A.9
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Raghavachari, K.11
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Zakrzewski, V.G.13
Ortiz, J.V.14
Foresman, J.B.15
Cioslowski, J.16
Stefanov, B.B.17
Nanayakkara, A.18
Challacombe, M.19
Peng, C.Y.20
Ayala, P.Y.21
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Andres, J.L.24
Replogle, E.S.25
Gomperts, R.26
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Stewart, J.P.32
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Frisch, M.J.; Trucks, G.W.; Schlegel, H.B.; Gill, P.M.W.; Johnson, B.G.; Robb, M.A.; Cheeseman, J.R.; Keith, T.; Petersson, G.A.; Montgomery, J.A.; Raghavachari, K.; Al-Laham, M.A.; Zakrzewski, V.G.; Ortiz, J.V.; Foresman, J.B.; Cioslowski, J.; Stefanov, B.B.; Nanayakkara, A.; Challacombe, M.; Peng, C.Y.; Ayala, P.Y.; Chen, W.; Wong, M.W.; Andres, J.L.; Replogle, E.S.; Gomperts, R.; Martin, R.L.; Fox, D.J.; Binkley, J.S.; Defrees, D.J.; Baker, J.; Stewart, J.P.; Head-Gordon, M.; Gonzalez, C.; Pople, J.A. Gaussian 94, revision x.x; Gaussian, Inc.: Pittsburgh, PA, 1995. The program provides statistical mechanical corrections as described in Statistical Mechanics by Donald A. McQuarrie (1976) page 138.
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Jolly, W.L. Chem. Rev. 1952, 59, 351. Using the data from Table 3 the standard enthalpy of ammonation of the RbBr pair is -681.1 kJ/mol so that the equality assumption means that the value for the Br ion is -340.6 kJ/mol. Again using the data from Table 3 the standard enthalpy of ammonation of the HBr pair is -1564 kJ/mol, which then combines with the -341 kJ/mol for the Br ion to give -1223 kJ/mol for the standard absolute enthalpy of ammonation of the proton.
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Jolly, W.L.1
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