Gas-phase enthalpies of formation, acidities, and strain energies of the [m, n]polyprismanes (m ≥ 2; n = 3–8; m × n ≤ 16): a CBS-Q//B3, G4MP2, and G4 theoretical study-Reference-Cited by-同舟云学术

Gas-phase enthalpies of formation, acidities, and strain energies of the [m, n]polyprismanes (m ≥ 2; n = 3–8; m × n ≤ 16): a CBS-Q//B3, G4MP2, and G4 theoretical study

Published:2010-07-14 Issue:5-6 Volume:127 Page:697-709
ISSN:1432-881X
Container-title:Theoretical Chemistry Accounts
language:en
Short-container-title:Theor Chem Acc

Author:

Rayne Sierra,Forest Kaya

Publisher

Springer Science and Business Media LLC

Subject

Physical and Theoretical Chemistry

Link

http://link.springer.com/content/pdf/10.1007/s00214-010-0780-0.pdf

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4. Walker JE, Adamson PA, Davis SR (1999) Comparison of calculated hydrocarbon strain energies using ab initio and composite methods. J Mol Struct Theochem 487:145–150

5. Earley CW (2000) Ab initio investigation of strain in group 14 polyhedrane clusters (MnHn: n = 4, 6, 8, 10, 12, 16, 20, 24). J Phys Chem A 104:6622–6627

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