An optimized force field for crystalline phases of resorcinol.
no === The two known crystalline phases of resorcinol and their phase transitions are of considerable interest. The crystals exhibit pyro- and piezo-electricity and, remarkably, the higher temperature phase is the denser phase. Furthermore, crystals of the phase, by virtue of having a polar axis, ha...
Main Authors: | , , , |
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Language: | en |
Published: |
Royal Society of Chemistry
2011
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Subjects: | |
Online Access: | http://hdl.handle.net/10454/4733 |