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Predictions of the Properties of Water from First Principles

✍ Scribed by Bukowski, R.; Szalewicz, K.; Groenenboom, G. C.; van der Avoird, A.


Book ID
111861754
Publisher
American Association for the Advancement of Science
Year
2007
Tongue
English
Weight
244 KB
Volume
315
Category
Article
ISSN
0036-8075

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