Direct space methods for powder X-ray diffraction for guest-host materials: Applications to cage occupancies and guest distributions in clathrate hydrates

Journal of the American Chemical Society

Volumn 132, Issue 2, 2010, Pages 524-531

  Takeya, Satoshi ^a,b   Udachin, Konstantin A ^a   Moudrakovski, Igor L ^a   Susilo, Robin ^a   Ripmeester, John A ^a,b  

^a NATIONAL RESEARCH COUNCIL CANADA   (Canada)

^b NATIONAL INSTITUTE OF ADVANCED INDUSTRIAL SCIENCE AND TECHNOLOGY AIST   (Japan)

Author keywords

[No Author keywords available]

Indexed keywords

AB INITIO CRYSTAL STRUCTURES; BINARY HYDRATES; CLATHRATE HYDRATE; COMPLEX MATERIALS; CRYSTAL CLASS; CRYSTALLINE POWDER; CRYSTALLINE SAMPLES; DYNAMICAL DISORDER; EXPERIMENTAL DATA; GUEST MOLECULES; GUEST-HOST; HOST-GUESTS; METHYLCYCLOHEXANE; MOLECULAR DYNAMICS SIMULATIONS; NEOHEXANE; POWDER SAMPLES; POWDER X RAY DIFFRACTION; SINGLE CRYSTAL X-RAY DIFFRACTION; SOLID STATE NMR; SOLID-STATE NMR SPECTROSCOPY; STRUCTURAL DETERMINATION; TERT-BUTYL METHYL ETHERS;

CRYSTAL STRUCTURE; CRYSTALLINE MATERIALS; DIFFRACTION; ETHERS; HYDRATION; MOLECULAR DYNAMICS; NUCLEAR MAGNETIC RESONANCE; NUCLEAR MAGNETIC RESONANCE SPECTROSCOPY; RIETVELD ANALYSIS; RIETVELD METHOD; SINGLE CRYSTALS; SOLID STATE PHYSICS; SOUND INSULATING MATERIALS; X RAY DIFFRACTION;

HYDRATES;

ARGON; HEXANE; KRYPTON; METHYLCYCLOHEXANE; TERT BUTYL METHYL ETHER; XENON;

ARTICLE; CARBON NUCLEAR MAGNETIC RESONANCE; CRYSTAL STRUCTURE; MOLECULAR DYNAMICS; NEUTRON DIFFRACTION; NUCLEAR MAGNETIC RESONANCE SPECTROSCOPY; SOLID STATE; STOICHIOMETRY; X RAY DIFFRACTION;

EID: 74949097466     PISSN: 00027863     EISSN: None     Source Type: Journal    
DOI: 10.1021/ja905426e     Document Type: Article

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