DOI: 10.1126/science.271.5245.59. Quantifying Hydrogen Bond Cooperativity in Water: VRT Spectroscopy of the Water Tetramer

Quantifying Hydrogen Bond Cooperativity in Water: VRT Spectroscopy of the Water Tetramer

10.1126/science.271.5245.59

Crossref journal-article

American Association for the Advancement of Science (AAAS)

Science (221)

Abstract

Measurement of the far-infrared vibration-rotation tunneling spectrum of the perdeuterated water tetramer is described. Precisely determined rotational constants and relative intensity measurements indicate a cyclic quasi-planar minimum energy structure, which is in agreement with recent ab initio calculations. The O-O separation deduced from the data indicates a rapid exponential convergence to the ordered bulk value with increasing cluster size. Observed quantum tunneling splittings are interpreted in terms of hydrogen bond rearrangements connecting two degenerate structures.

Bibliography

Cruzan, J. D., Braly, L. B., Liu, K., Brown, M. G., Loeser, J. G., & Saykally, R. J. (1996). Quantifying Hydrogen Bond Cooperativity in Water: VRT Spectroscopy of the Water Tetramer. Science, 271(5245), 59â62.

Authors 6

J. D. Cruzan (first)
L. B. Braly (additional)
Kun Liu (additional)
M. G. Brown (additional)
J. G. Loeser (additional)
R. J. Saykally (additional)

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Dates

Type	When
Created	18 years, 9 months ago (Oct. 27, 2006, 2:30 p.m.)
Deposited	1 year, 7 months ago (Jan. 12, 2024, 6:12 p.m.)
Indexed	1 month, 1 week ago (July 11, 2025, 9:17 p.m.)
Issued	29 years, 7 months ago (Jan. 5, 1996)
Published	29 years, 7 months ago (Jan. 5, 1996)
Published Print	29 years, 7 months ago (Jan. 5, 1996)

Funders 0

None

BibTeX

@article{Cruzan_1996, title={Quantifying Hydrogen Bond Cooperativity in Water: VRT Spectroscopy of the Water Tetramer}, volume={271}, ISSN={1095-9203}, url={http://dx.doi.org/10.1126/science.271.5245.59}, DOI={10.1126/science.271.5245.59}, number={5245}, journal={Science}, publisher={American Association for the Advancement of Science (AAAS)}, author={Cruzan, J. D. and Braly, L. B. and Liu, Kun and Brown, M. G. and Loeser, J. G. and Saykally, R. J.}, year={1996}, month=jan, pages={59–62} }

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