Chemical bonding in pentaerythritol at very low temperature or at high pressure: an experimental and theoretical study

Zhurova, E.A.; Tsirelson, V.G.; Zhurov, V.V.; Stash, A.I.; Pinkerton, A.A.

doi:10.1107/S0108768106008329

Acta Crystallographica Section B
Acta Crystallographica
Section B STRUCTURAL SCIENCE, CRYSTAL ENGINEERING AND MATERIALS

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Figure 6
Electronic energy density (a) along the O1⋯H3 line (hydrogen bond within molecular layers) and (b) along the O1⋯H1 line (hydrogen bond between molecular layers). The O atom was placed at r = 0 and the corresponding hydrogen is located at the appropriate distance (Table 2

STRUCTURAL SCIENCE
CRYSTAL ENGINEERING
MATERIALS

ISSN: 2052-5206

Volume 62| Part 3| May 2006| Pages 513-520

doi:10.1107/S0108768106008329

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