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AbstractAbstract
[en] We use variable-pressure neutron and X-ray diffraction measurements to determine the uniaxial and bulk compressibilities of nickel(II) cyanide, Ni(CN)_2. Whereas other layered molecular framework materials are known to exhibit negative area compressibility, we find that Ni(CN)_2 does not. We attribute this difference to the existence of low-energy in-plane tilt modes that provide a pressure-activated mechanism for layer contraction. The experimental bulk modulus we measure is about four times lower than that reported elsewhere on the basis of density functional theory methods [Phys. Rev. B 83 (2011) 024301].
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S0921-4526(15)30239-8; Available from http://dx.doi.org/10.1016/j.physb.2015.09.027; Copyright (c) 2015 Elsevier Science B.V., Amsterdam, The Netherlands, All rights reserved.; Country of input: International Atomic Energy Agency (IAEA)
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