1972
DOI: 10.1021/j100649a015
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Thermodynamic properties of hydrated and ammoniated electrons

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Cited by 39 publications
(15 citation statements)
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“…This value seems reasonable if compared to literature values. With increasing cluster size, the EA is expected to asymptotically approach 1.65 eV which is the heat of solvation determined for the condensed phase hydrated electron [29]. Barnett et al [30,31] have reported a model which adapts a dielectric continuum framework in describing the size dependence of the EA's of neutral water clusters, and using their model we can estimate EA's of 0.73, 1.25, and 1.49 eV for n = 10 2 , 10 3 , and 10 4 , respectively.…”
Section: Discussionmentioning
confidence: 92%
“…This value seems reasonable if compared to literature values. With increasing cluster size, the EA is expected to asymptotically approach 1.65 eV which is the heat of solvation determined for the condensed phase hydrated electron [29]. Barnett et al [30,31] have reported a model which adapts a dielectric continuum framework in describing the size dependence of the EA's of neutral water clusters, and using their model we can estimate EA's of 0.73, 1.25, and 1.49 eV for n = 10 2 , 10 3 , and 10 4 , respectively.…”
Section: Discussionmentioning
confidence: 92%
“…However, their calculated values of EA(n) appear to be overestimations, given that they are larger than the corresponding experimental VDE(n) values, and that their EA(n) values appear to be on a course that would overestimate EA(ϱ), i.e., the literature value of ⌬H s for bulk ammoniated electrons. 51,52 In subsequent work, these authors explain that such overestimations are expected within this model, since it uses only a pair-potential approximation, neglecting induced polarization which would serve to decrease the effective polarization. 17 Later, a refined dielectric sphere model was presented by Landman and co-workers, 15,16,[53][54][55] and also by Stampfli and Bennemann themselves.…”
Section: Discussionmentioning
confidence: 99%
“…The EA a 's for the larger clusters are expected to approach 1.65 eV asymptotically; the limiting adiabatic value corresponds to ⌬H s , the heat of solvation for the condensed phase hydrated electron. 19,20 Barnett et al 21,22 have reported a model which adapts a dielectric continuum framework in describing the size dependence of the water cluster anion vertical detachment energies ͑VDE's͒ and the EA a 's of the neutral water clusters. The VDE's and the EA a 's are represented as follows:…”
Section: Discussionmentioning
confidence: 99%