Job vacancies at ISIS

2007-10-03 Thread Radaelli, PG \(Paolo\)
Hello, There are two positions available in the ISIS Crystallography group: FBU127 Instrument Scientist - Magnetic Diffraction Department ISIS Department Summary: We are looking for a highly motivated and independent scientist, who will take the lead in commissioning WISH, develop

XPRESS access mechanism

2005-07-05 Thread Radaelli, PG \(Paolo\)
Dear Colleague, Starting from cycle 2004/03 (April-May 2005), ISIS has started to offer a Measure-by-Courier powder diffraction access mechanism to the GEM diffractometer (XPRESS). This mechanism is aimed at new and infrequent users, research programmes requiring only limited and/or

bursaries available: Neutron Scattering from Biological Systems

2004-11-03 Thread Radaelli, PG (Paolo)
The Institute of Physics and the Faraday Division of the Royal Society of Chemistry Neutron Scattering Group Student and Young researcher bursaries available for Neutron Scattering from Biological Systems Cosener's House, Abingdon, OXON, 13-14 December 2004 The Neutron Scattering Group is

Meeting Announcement: Neutron Scattering from Biological Systems

2004-10-20 Thread Radaelli, PG (Paolo)
Autumn Meeting 2004 BCA Physical Crystallography Group and the IoP Structural Condensed Matter Physics Group Neutron Scattering from Biological Systems Cosener's House, Abingdon, OXON, 13-14 December 2004 Hosted at Cosener's House, Abingdon, OXON and supported by the PCG and Rutherford

RE: Rietveld refinement and PDF refinement ?

2004-08-23 Thread Radaelli, PG (Paolo)
do you really have the resolution even on HRPD to see the diffuse scattering between Bragg peaks at high Q ? No we don't, but this is not the main point (by the way, we don't use HRPD for PDF, it doesn't go to sufficiently short wavelengths). The main reason to go to high Q is to avoid

RE: Rietveld refinement and PDF refinement ?

2004-08-22 Thread Radaelli, PG (Paolo)
I would argue that the Bragg diffuse scattering both reflect the average instantaneous atomic structure. Yes. If you integrate over energy, the scattering function factors to a delta function in time, corresponding to an instantaneous snapshot of the spatial correlations. It is not a question

RE: Rietveld refinement and PDF refinement ?

2004-08-22 Thread Radaelli, PG (Paolo)
Two very good points by Armel: all the very good PDF studies ...are made by using synchrotron data or neutron data from spallation sources This is because they are the only means to get to high Q (i.e., high resolution in real space) and sufficiently high resolution (in reciprocal space)

RE: Rietveld refinement and PDF refinement ?

2004-08-19 Thread Radaelli, PG (Paolo)
The only truly unique PDF information is about *correlations*. Let's say you have two bonded sites, both with anisotropic thermal ellipsoids along the bond, and let's assume that the motion is purely harmonic. A sharp PDF peak will indicate that the atoms move predominanly in-phase, a broad PDF

RE: Debye Temperature Lattice Thermal Expansion

2001-07-05 Thread Radaelli, PG (Paolo)
This is to answer the question from Alexandros: The simplest approximation to the thermal expansion coefficient uses the Debye or Einstein specific heat through the so-called Gruneisen formula alpha=gamma*cv/(3*B*Vm) where alpha is the linear expansion coefficient (1/3 of the volume TEC), B

Job Opening

2001-06-12 Thread Radaelli, PG (Paolo)
ARGONNE NATIONAL LABORATORY/ISIS NEUTRON FACILITY POSTDOCTORAL POSITION The Materials Science Division at Argonne National Laboratory is seeking candidates for a postdoctoral research associate position in neutron diffraction. The successful candidate will be located predominantly at the ISIS

RE: Most cited powder diffraction papers

2001-03-28 Thread Radaelli, PG (Paolo)
Armil: What criterion was adopted in the search? The following famous paper, clearly of structural subject, is not on your list, but has 768 citations: STRUCTURAL-PROPERTIES OF OXYGEN-DEFICIENT YBA2CU3O7-DELTA JORGENSEN JD, VEAL BW, PAULIKAS AP, NOWICKI LJ, CRABTREE GW, CLAUS H, KWOK WK

post-doc position at MSU-ISIS

2001-02-21 Thread Radaelli, PG (Paolo)
MICHIGAN STATE UNIVERSITY/ISIS NEUTRON FACILITY POSTDOCTORAL POSITION The Department of Physics and Astronomy at Michigan State University is looking to fill a postdoctoral research associate position in the local-structure-property relationship of complex oxides. The successful candidate will

RE: Thermal Parameters and Occupancies

2000-10-10 Thread Radaelli, PG (Paolo)
One important consideration on the issue of thermal parameters vs occupancies is the Q-range (Q=4pisin(theta)/lambda) where useful information exists. This is a function of the wavelength used, the resolution, the complexity of the structure and the radiation (x-rays vs neutrons). The best

RE: Riet_L: Scale factor in Rietveld (with a question for Bob and Juan)

2000-09-15 Thread Radaelli, PG (Paolo)
Hi everybody: Here is a useful couple of formulas for you neutron lot. They can be used to predict in advance the Rietveld scale factor S for a TOF powder pattern. I remind you that the profile intensity Y is defined as Y=S|F|^2*H(T-Thkl)*L*A*E*O/Vo (see old GSAS manual, page 122). The

RE: Lorentz Factor in TOF neutron diffraction

2000-09-08 Thread Radaelli, PG (Paolo)
To answer Nail's question: The Lorentz factor can be deduced from the expression of the integrated intensity of a single reflection of a TOF powder pattern (in the absence of attenuation): I=[e(lam)*Omega]*[Vs/(32*pi*Vu^2)]*[lam^4*i(lam)]*[1/sin^3(theta)]*[Mhkl*|Fh kl|^2]=