Published February 9, 2005
| Version v1
Journal article
Orientational correlations in liquid carbon monoxide and nitric oxide
Creators
- 1. Research Institute for Solid State Physics and Optics, PO Box 49, H-1525 Budapest (Hungary)
Description
Neutron diffraction results obtained for liquid CO and NO have been modelled by means of the reverse Monte Carlo method. Partial pair correlation functions, centre-centre pair correlation functions and the relative orientations of molecular axes as a function of distances between molecular centres have been calculated from the models. It was found that, contrary to earlier suggestions, well defined orientational correlations exist in liquid carbon monoxide, even at lower densities. For liquid nitric oxide, the existence of (NO)2 dimers has been confirmed, but the 'cis-planar' structure of the dimers, suggested earlier, could not be made consistent with available diffraction data
Availability note (English)
Available online at http://stacks.iop.org/0953-8984/17/S47/cm5_5_006.pdf or at the Web site for the Journal of Physics. Condensed Matter (ISSN 1361-648X) http://www.iop.org/Additional details
Identifiers
- URL
- http://stacks.iop.org/0953-8984/17/S47/cm5_5_006.pdf; http://www.iop.org/;
- DOI
- 10.1088/0953-8984/17/5/006;
- PII
- S0953-8984(05)89338-5;
Publishing Information
- Journal Title
- Journal of Physics. Condensed Matter
- Journal Volume
- 17
- Journal Issue
- 5
- Journal Page Range
- p. S47-S57
- ISSN
- 0953-8984
- CODEN
- JCOMEL
Conference
- Title
- The first fifteen years of reverse Monte Carlo modelling
- Acronym
- 2. workshop on reverse Monte Carlo (RMC) methods
- Dates
- 9-11 Oct 2003
- Place
- Budapest (Hungary)
INIS
- Country of Publication
- United Kingdom
- Country of Input or Organization
- International Atomic Energy Agency (IAEA)
- INIS RN
- 36035471
- Subject category
- S75: CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND SUPERFLUIDITY; S36: MATERIALS SCIENCE;
- Resource subtype / Literary indicator
- Conference
- Descriptors DEI
- CARBON MONOXIDE; COMPUTERIZED SIMULATION; CORRELATION FUNCTIONS; DIMERS; INTERATOMIC DISTANCES; MONTE CARLO METHOD; NEUTRON DIFFRACTION; NITRIC OXIDE
- Descriptors DEC
- CALCULATION METHODS; CARBON COMPOUNDS; CARBON OXIDES; CHALCOGENIDES; COHERENT SCATTERING; DIFFRACTION; DISTANCE; FUNCTIONS; NITROGEN COMPOUNDS; NITROGEN OXIDES; OXIDES; OXYGEN COMPOUNDS; SCATTERING; SIMULATION