Deuterium oxide

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Gas phase ion energetics data

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Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.

Data compiled as indicated in comments:
LBLHLM - Sharon G. Lias, John E. Bartmess, Joel F. Liebman, John L. Holmes, Rhoda D. Levin, and W. Gary Mallard
LLK - Sharon G. Lias, Rhoda D. Levin, and Sherif A. Kafafi
RDSH - Henry M. Rosenstock, Keith Draxl, Bruce W. Steiner, and John T. Herron

Ionization energy determinations

IE (eV) Method Reference Comment
12.6395 ± 0.0003PEReutt, Wang, et al., 1986LBLHLM
12.65 ± 0.03EILefaivre and Marmet, 1978LLK
12.637SGurtler, Saile, et al., 1977LLK
12.639PEBotter and Carlier, 1977LLK
12.637PEDixon, Duxbury, et al., 1976LLK
12.633 ± 0.001PEKarlsson, Mattson, et al., 1975LLK
12.633 ± 0.001PEBergmark, Karlsson, et al., 1974LLK
12.636 ± 0.006SKatayama, Huffman, et al., 1973LLK
12.633PEAsbrink and Rabalais, 1971LLK
12.62 ± 0.01PEBrundle and Turner, 1968RDSH
13.7PEBrundle and Turner, 1968RDSH
17.26PEBrundle and Turner, 1968RDSH
12.637 ± 0.005PIBrehm, 1966RDSH

Appearance energy determinations

Ion AE (eV) Other Products MethodReferenceComment
D+18.75 ± 0.05ODPEEland, 1974LLK
D+18.7 ± 0.05OD(X2P)EIAppell and Durup, 1973LLK
OD+18.219 ± 0.008DPIMcCulloh, 1976LLK
OD+18.19 ± 0.03DPEEland, 1974LLK
O+29.3 ± 0.32D?EICottin, 1959RDSH


Go To: Top, Gas phase ion energetics data, Notes

Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.

Reutt, Wang, et al., 1986
Reutt, J.E.; Wang, L.S.; Lee, Y.T.; Shirley, D.A., Molecular beam photoelectron spectroscopy and femtosecond intramolecular dynamics of H2O+ and D2O+, J. Chem. Phys., 1986, 85, 6928. [all data]

Lefaivre and Marmet, 1978
Lefaivre, D.; Marmet, P., Electroionization of D2O and H2O and study of fragments H+ and OH+, Can. J. Phys., 1978, 56, 1549. [all data]

Gurtler, Saile, et al., 1977
Gurtler, P.; Saile, V.; Koch, E.E., Rydberg series in the absorption spectra of H2O and D2O in the vacuum ultraviolet, Chem. Phys. Lett., 1977, 51, 386. [all data]

Botter and Carlier, 1977
Botter, R.; Carlier, J., Spectre de photoelectrons et calcul des facteurs de Franck-Condon pour H2O, D2O, HDO, J. Electron Spectrosc. Relat. Phenom., 1977, 12, 55. [all data]

Dixon, Duxbury, et al., 1976
Dixon, R.N.; Duxbury, G.; Rabalais, J.W.; Asbrink, L., Rovibronic structure in the photoelectron spectra of H2O, D2O and HDO, Mol. Phys., 1976, 31, 423. [all data]

Karlsson, Mattson, et al., 1975
Karlsson, L.; Mattson, L.; Jadrny, R.; Albridge, R.G.; Pinchas, S.; Bergmark, T.; Siegbahn, K., Isotopic and vibronic coupling effects in the valence electron spectra of H216O, H218O, and D216O, J. Chem. Phys., 1975, 62, 4745. [all data]

Bergmark, Karlsson, et al., 1974
Bergmark, T.; Karlsson, L.; Jadrny, R.; Mattsson, L.; Albridge, R.G.; Siegbahn, K., Isotopic effects in the electron spectra of H216O, H218O, and D216O, J. Electron Spectrosc. Relat. Phenom., 1974, 4, 85. [all data]

Katayama, Huffman, et al., 1973
Katayama, D.H.; Huffman, R.E.; O'Bryan, C.L., Absorption and photoionization cross sections for H2O and D2O in the vacuum ultraviolet, J. Chem. Phys., 1973, 59, 4309. [all data]

Asbrink and Rabalais, 1971
Asbrink, L.; Rabalais, J.W., Comments on the high resolution photoelectron spectrum of H2O and D2O, Chem. Phys. Lett., 1971, 12, 182. [all data]

Brundle and Turner, 1968
Brundle, C.R.; Turner, D.W., High resolution molecular photoelectron spectroscopy. II.Water and deuterium oxide, Proc. Roy. Soc. (London), 1968, A307, 27. [all data]

Brehm, 1966
Brehm, B., Massenspektrometrische Untersuchung der Photoionisation von Molekulen, Z. Naturforsch., 1966, 21a, 196. [all data]

Eland, 1974
Eland, J.H.D., Predissociation of triatomic ions studied by photoelectron-photoion coincidence spectroscopy, Adv. Mass Spectrom., 1974, 6, 917. [all data]

Appell and Durup, 1973
Appell, J.; Durup, J., The formation of protons by impact of low energy electrons on water molecules, Int. J. Mass Spectrom. Ion Phys., 1973, 10, 247. [all data]

McCulloh, 1976
McCulloh, K.E., Energetics and mechanisms of fragment ion formation in the photoionization of normal and deuterated water and ammonia, Int. J. Mass Spectrom. Ion Phys., 1976, 21, 333. [all data]

Cottin, 1959
Cottin, M., Etude des ions produits par impact electronique dans la vapeur d'eau, J. Chim. Phys., 1959, 56, 1024. [all data]


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