Re: Stacking faults and antiphase boundary

2014-04-02 Thread Luca Lutterotti
titute of Chemistry and Chemical Technology 660049, K. Marx 42, Krasnoyarsk, Russia http://sites.google.com/site/solovyovleonid *** From: Luca Lutterotti To: "rietveld_l@ill.fr" Sent: Wednesday, June 26, 2013 5:19 PM Subject: Re: Stacki

[no subject]

2014-04-03 Thread Luca Lutterotti
Dear Leonid, On Apr 3, 2014, at 7:16, Leonid Solovyov wrote: >Dear Luca, > >I'm glad to see your interest to the problem even after such a delay. > >>So in the end, your model for faulting as you describe: >>"A more general model [J Appl Cryst (2000) 338] is included in DDM:" was to use a trigon

Re: Stacking faults and antiphase boundary

2014-04-03 Thread Luca Lutterotti
Solovyov > Institute of Chemistry and Chemical Technology > 660036, Akademgorodok 50/24, Krasnoyarsk, Russia > http://sites.google.com/site/solovyovleonid > ******* > > > - Original Message - > From: Luca Lutterotti &g

Re: Stacking faults and antiphase boundary

2014-04-04 Thread Luca Lutterotti
***** > >   > > - Original Message - > From: Luca Lutterotti > To: Leonid Solovyov > Cc: Luca Lutterotti ; "rietveld_l@ill.fr" > Sent: Friday, April 4, 2014 1:20 PM > Subject: Re: Stacking faults and antiphase boundary > > Sorr

Re: Stacking faults and antiphase boundary

2014-04-07 Thread Luca Lutterotti
Glad the discussion is opening a bit. Actually the Ice case is a bit different from the point of view of the defects. These are turbostratic planar defects (in the case of close packed alloys you have twins and intrinsic and extrinsic deformation faults). Now it is true that there is not a big dif

Re: Anomalous scattering factor and Dispersion coefficients

2015-06-11 Thread Luca Lutterotti
John is correct, be careful that you are trying to compare same quantities but in a completely different units and definitions. I discover by myself that you cannot mix scattering factors, absorption factors, photo absorption etc. coming some from the diffraction community and some from the spec

Re: TOPAS Macro Language (peak shape broadening macros)

2015-06-24 Thread Luca Lutterotti
gh improved sample preparation) than to try to > model it. We actually use preferred orientation (texture) to help structure solution, and I found more easy to model them than to eliminate them. But may be is just me. Best regards, Luca Lutterotti ------

Maud school on combined analysis in Trento, October 2015

2015-06-26 Thread Luca Lutterotti
k will appear soon on such page. For the moment you will find only the scientific program information, dates and location. Best regards, Luca ---Luca Lutterotti Dipartimento di Ingegneria Industriale, Universita' di

Re: Stoichiometry and occupancy fractions of solid solutions

2016-12-20 Thread Luca Lutterotti
d_X-Ray_diffraction_and_fluorescence_analysis_in_the_cultural_heritage_field> Best regards, Luca ---Luca Lutterotti Dipartimento di Ingegneria Industriale, Universita' di Trento, via Sommarive, 9, 38123 Trento, Italy e-mail address : l

Re: Stoichiometry and occupancy fractions of solid solutions

2016-12-20 Thread Luca Lutterotti
Sorry, here is the direct link to the journal article if you have the subscription: http://www.sciencedirect.com/science/article/pii/S0026265X15003756 <http://www.sciencedirect.com/science/article/pii/S0026265X15003756> Luca ---Luca Lutt

Re: Hippo wizard in Maud

2018-07-02 Thread Luca Lutterotti
wizard works with the option on. Best regards, Luca ---Luca Lutterotti Dipartimento di Ingegneria Industriale, Universita' di Trento, via Sommarive, 9, 38123 Trento, Italy e-mail address : luca.luttero...@uni

Re: Simultaneous refinement of multiple atoms sharing same site

2019-09-02 Thread Luca Lutterotti
With 3 atoms, as Larry and Alan explain it cannot be done unless you have additional info (e.g. chemical info). In our lab, if the three atoms or at least 2 are in the range for XRF, we do a combined XRD+XRF refinement. Luca ---Luca Lutterotti

Re: Rietveld condamnation considered as established by some more people

2023-08-17 Thread Luca Lutterotti
oot on the original code. Luca <http://www.unitn.it/> Luca Lutterotti Dipartimento di Ingegneria Industriale Università di Trento via Sommarive, 9 - 38123 Trento (Italy) tel. +39 0461 2824-14 (Office), -34 (X-Ray lab)  Maud: http://maud.radiographema.com <http://maud.radiograph

Re: [EXT] [External] Re: Step-like basline

2023-09-04 Thread Luca Lutterotti
st regards, Luca <http://www.unitn.it/> Luca Lutterotti Dipartimento di Ingegneria Industriale Università di Trento via Sommarive, 9 - 38123 Trento (Italy) tel. +39 0461 2824-14 (Office), -34 (X-Ray lab)  Maud: http://maud.radiographema.com <http://maud.radiographema/> >

Fwd: [EXT] [External] Re: Step-like basline

2023-09-05 Thread Luca Lutterotti
cellphones (I have a prototype running there). Best regards, Luca <http://www.unitn.it/> Luca Lutterotti Dipartimento di Ingegneria Industriale Università di Trento via Sommarive, 9 - 38123 Trento (Italy) tel. +39 0461 2824-14 (Office), -34 (X-Ray lab)  Maud: http://maud.radiographe

Re: Step-like basline

2023-09-06 Thread Luca Lutterotti
. Best regards, Luca <http://www.unitn.it/> Luca Lutterotti Dipartimento di Ingegneria Industriale Università di Trento via Sommarive, 9 - 38123 Trento (Italy) tel. +39 0461 2824-14 (Office), -34 (X-Ray lab)  Maud: http://maud.radiographema.com <http://maud.radiographema/>

Re: [EXT] [External] Re: Step-like basline

2023-09-06 Thread Luca Lutterotti
from a database (even the speedy ones) than to re-calculate everything. So I am glad we both made use of each other models/ideas! Best regards, Luca <http://www.unitn.it/> Luca Lutterotti Dipartimento di Ingegneria Industriale Università di Trento via Sommarive, 9 - 38123

Re: FPSM : (was Re: [EXT] [External] Re: Step-like basline)

2023-09-07 Thread Luca Lutterotti
developed it without in reality ;-) Thanks Reinhard for the explanation of WPF related to Search-match. I can only see the advertisement/brochure and I didn’t know what exactly they do or mean with it. Best regards, Luca <http://www.unitn.it/> Luca Lutterotti Dipartimento di Inge

Re: FPSM : (was Re: [EXT] [External] Re: Step-like basline)

2023-09-07 Thread Luca Lutterotti
To be more clear, they did not ask for anything except that such a paper should never be published! Luca <http://www.unitn.it/> Luca Lutterotti Dipartimento di Ingegneria Industriale Università di Trento via Sommarive, 9 - 38123 Trento (Italy) tel. +39 0461 2824-14 (Office), -34 (X-R

Re: Misconduct

2024-01-13 Thread Luca Lutterotti
t;http://www.unitn.it/> Luca Lutterotti Dipartimento di Ingegneria Industriale Università di Trento via Sommarive, 9 - 38123 Trento (Italy) tel. +39 0461 2824-14 (Office), -34 (X-Ray lab)  Maud: http://maud.radiographema.com <http://maud.radiographema/> > On 13 Jan 2024, at 07:39, A

Re: Misconduct

2024-01-16 Thread Luca Lutterotti
😂 That’s the best message of the year! I should remember it. Luca > On 16 Jan 2024, at 15:22, Alan W Hewat wrote: > > Ha ! When Terry Sabine proposed to call it Rietveld Refinement, I told him > that Rietveld was already "refined". > > > Dr Alan Hewat, Neu

Re: Comments on "Importance of matching software with hardware"

1999-03-26 Thread Luca Lutterotti
- first the plot is at iso-error. In the residual you can easily distinguish statistical errors from model errors. - small peaks are more visibles. Try it on the quartz; you will not need anymore to zoom the plot on the other peaks. Just my 0.2 cents, best regards,

Re: Stress

1999-05-18 Thread Luca Lutterotti
tresses. Let me stress the audience about that; may be is that I am an engineer and not a physicist or chemist. best regards, Luca Lutterotti ---Luca Lutterotti Dipartimento di Ingegneria dei Materiali, Universita' di Trent

Re: crystallite size determination

1999-05-19 Thread Luca Lutterotti
sis are in L. Lutterotti & P. Scardi, Adv. in X-ray Anal. 35, 577. Best regards, Luca Lutterotti -------Luca Lutterotti Dipartimento di Ingegneria dei Materiali, Universita' di Trento, via Mesiano 77, 38

Re: "Resolution"

1999-09-27 Thread Luca Lutterotti
because I remember Von Dreele presenting something on anysotropic broadening two years ago. May be others program are availables too. Best regards, Luca Lutterotti ---Luca Lutterotti Dipartimento di Ingegneria

BaSiF6 or CaSiF6 structures

1999-01-16 Thread Luca Lutterotti
vance, Luca Lutterotti ---Luca Lutterotti Dipartimento di Ingegneria dei Materiali, Universita' di Trento, via Mesiano 77, 38050 Trento, Italy e-mail address : [EMAIL PROTECTED] Home page : http://www.ing.unitn.it/~luttero Mi

Re: BaSiF6 or CaSiF6 structures, thanks

1999-01-17 Thread Luca Lutterotti
for the very fast help, Luca Lutterotti ---Luca Lutterotti Dipartimento di Ingegneria dei Materiali, Universita' di Trento, via Mesiano 77, 38050 Trento, Italy e-mail address : [EMAIL PROTECTED] Home page :

Re: X-ray film data analysis

2000-03-09 Thread Luca Lutterotti
to account film saturation, but the results were equivalent to a normal diffractometer. Best regards, Luca Lutterotti ---Luca Lutterotti Dipartimento di Ingegneria dei Materiali, Universita

Re: Peak Shape variation

2000-08-01 Thread Luca Lutterotti
(a.k.a Warren theories for twin, stacking faults and/or antiphase boundary). Maud can be used in this case but the actual general model only works for bcc, fcc, hcp structures. No general approach available up to now. Probably you may give some more information about the

Re: Peak Shape variation

2000-08-08 Thread Luca Lutterotti
peak width but also asymmetry, peak shift and splitting. See Warren book for more. or try Maud. Best regards, Luca Lutterotti >> >> >> >> Dear All, >> >> >> >> I am trying to carry out Rietveld refineme

Re: SRMs 640c & 660a

2000-09-28 Thread Luca Lutterotti
ect it not to change on the 4 digit in Angstrom. So what it's certified by NIST? The accuracy of the Silicon standard or the precision of the NIST machine used for the measurement? Should we need a round robin on SRM 640c to decide what it could be the acceptable mean parameter value

Re: SRMs 640c & 660a

2000-09-29 Thread Luca Lutterotti
"was" different? Sorry for the question, but I personally and philosophically don't think we can measure absolute values.. Best regards, Luca Lutterotti ---Luca Lutterotti Dipartimento di Inge

Re: Natrite - Na2 CO3

2000-11-13 Thread Luca Lutterotti
nt to see some comment on that.... Best regards, Luca Lutterotti Ps - Even if I am in Italy, I also have paid for the ICSD when it was selling much less copies but the cost is still the same now. ---Luca Lutterotti--

Re: ICSD - practical question...

2000-11-13 Thread Luca Lutterotti
ask to Bill, cheers, Luca Lutterotti -------Luca Lutterotti Dipartimento di Ingegneria dei Materiali, Universita' di Trento, via Mesiano 77, 38050 Trento, Italy e-mail address : [EMAIL PROTECTED]

Re: rietveld program (fwd)

2001-07-03 Thread Luca Lutterotti
structure broadening of intermetallics and I know that anisotropic models (like Popa, that's included also) don't work sufficiently well with this kind of broadening (that's the reason I have included the Warren theory previously mentioned). Best regards,

Re: Quantitive analysis

2004-05-06 Thread Luca Lutterotti
Analysis without internal standard (for example for bulk materials) can be done with Maud for glasses of other common amorphous phases. http://www.ing.unitn.it/~luttero/maud there is one example, plus a publication on line. Luca Lutterotti On May 6, 2004, at 4:56 PM, Robert Mauricot

Re: SPAM on Rietveld list under my name

2004-07-21 Thread Luca Lutterotti
On Jul 21, 2004, at 2:02 PM, Alan Hewat wrote: ... Of course, this is just some-one impersonating me Armel, we know you are ;-)) Luca

Re: back loading / texture effects

2004-09-09 Thread Luca Lutterotti
when I see still today these attachments sold around to reduce texture effects I cannot avoid to think about it (and laugh). Luca Lutterotti On Sep 9, 2004, at 16:30, Omotoso, Oladipo wrote: Dear Andreas, This may not be an option for your sample but grinding the s

Re: Size distribution from Rietveld refinement

2004-11-23 Thread Luca Lutterotti
regards, Luca Lutterotti On Nov 23, 2004, at 10:08, Nicolae Popa wrote: Good answer Davor, but why you are avoiding to say that if the size profile (15a, 21, 22) from JAC(2002)35, 338-346 (used in 3.1 of RR paper) would be implemented in the Rietveld codes these

Re: Size distribution from Rietveld refinement

2004-11-24 Thread Luca Lutterotti
Directly the distributions (both) using Fourier Transform (an FFT). Sufficiently fast, implementing it the correct way. Luca On Nov 24, 2004, at 12:14, Leonid Solovyov wrote: actually I implemented the size and strain distributions (both) in my Rietveld code (Maud) and I demoed it

Re: spherical hamonics

2005-02-18 Thread Luca Lutterotti
Even if the sample has a rolling (orthorhombic) sample symmetry, in a Bragg-Brentano pure experiment you see it as a cylindrical symmetry as you cannot distinguish between rotations around the normal to the sample. If you use a lower symmetry some of the spherical harmonic coefficients will not

Re: Experimental background!

2005-02-25 Thread Luca Lutterotti
Dear Nasser Afify, the problem is due to the fact that in the first case you are using a strong physical constraint, the nanocrystalline approximation. In the second one there are no restraints; the number of degrees of freedom are much more and you will always get a better fit. The real problem

Re: Size Strain In GSAS

2005-03-25 Thread Luca Lutterotti
Indeed it is possible to get at end some size-strain data, but quite hard as you have to do all correction later and out of the program. So it is like using GSAS for peak fitting, so better to use a peak fitting dedicated program. Best wishes, Luca Luttero

Re: Size Strain In GSAS

2005-03-25 Thread Luca Lutterotti
should be clarified). I would like to know what there is inside GSAS for crystallite size and microstrain analysis in particular. Best regards, Luca Lutterotti On Mar 25, 2005, at 12:55, Andreas Leineweber wrote: Dear all, I think the statement that one ca

Re: Size Strain In GSAS

2005-03-25 Thread Luca Lutterotti
2334-6871 INDIA /_/_/_/_/_/_/_/_/_/_/_/_/_/_/_/_/_/_/_/_/_/_/_/ - Original Message ----- From: Luca Lutterotti <[EMAIL PROTECTED]> Date: Friday, March 25, 2005 3:31 pm Dear Apu, I know I will start up a "good" debate here, but size-strain analysis with GSAS is a non-sense. The pr

Re: Level of Preferred Orientation

2005-04-01 Thread Luca Lutterotti
connections. Otherwise is just a black box that may lead to more errors than corrections. Best regards, Luca Lutterotti On Apr 1, 2005, at 17:44, P. Bhuv wrote: Hi, I would like to discuss a couple of questions raised by a referee;-( I am not sure if it is ethical

Re: stresses-crystal structure changes

2007-01-22 Thread Luca Lutterotti
Because you are collecting just in Bragg-Brentano condition, or if not for every collection you just see only one direction in the sample, not all together. And if you homogenize all together you will only observe a broadening of the peaks. Best regards, Luca Lutterotti

Re: Powder Diffraction In Q-Space

2007-02-21 Thread Luca Lutterotti
ovide a standard way to present the results for the benefit of comparisons. Best regards, Luca Lutterotti

Re: Powder Diffraction In Q-Space

2007-02-21 Thread Luca Lutterotti
Alan, if it is trivial to plot in the square root I presume it is already available in Topas as well GSAS and Fullprof just to mention few. And if it is so trivial and already available as a button options why no one is using it. Why every time I look at a paper with a Rietveld refinement

Re: Powder Diffraction In Q-Space

2007-02-21 Thread Luca Lutterotti
4814 -Original Message- From: Luca Lutterotti [mailto:[EMAIL PROTECTED] Sent: Wednesday, February 21, 2007 2:59 PM To: rietveld_l@ill.fr Subject: Re: Powder Diffraction In Q-Space Alan, if it is trivial to plot in the square root I presume it is already available in Topas as well GSAS and

Re: Powder Diffraction In Q-Space

2007-02-21 Thread Luca Lutterotti
quate in most cases but for analysis the conversion should be done properly; a point missed by many. cheers alan -Original Message- From: Luca Lutterotti [mailto:[EMAIL PROTECTED] Sent: Thursday, 22 February 2007 6:59 AM To: rietveld_l@ill.fr Subject: Re: Powder Diffraction In Q-Space

Re: Embedded plots, was Re: Powder Diffraction In Q-Space

2007-02-22 Thread Luca Lutterotti
ve in case some specifications, files and what we need to just finalize and optimize it in the shortest time as possible. Best regards, Luca Lutterotti Best, Jon On Thu, 22 Feb 2007, Alan Hewat wrote: Now this sounds interesting. Certainly the raw data should be archived

Re: wt% to volume percent

2007-03-12 Thread Luca Lutterotti
hases scale factors) no density involved. Best regards, Luca Lutterotti On Mar 10, 2007, at 11:52 PM, Mr. Tony Raftery wrote: Guys, can anyone send me description (or reference) for the conversion of weight percent to volume percent for a (solid) mixture - volume percent is favor

Re: Preferred orientation?

2008-05-08 Thread Luca Lutterotti
d the axis normal to the sample surface is not a valid change in orientation as nothing will change for texture; you have to change the sample inclination instead (omega or chi). Best Regards, Luca Lutterotti That's the simple test. Let us know what you find

Re: Preferred orientation?

2008-05-08 Thread Luca Lutterotti
be related to sample preparation. Reinhard Luca Lutterotti schrieb: On May 8, 2008, at 12:30 AM, May, Frank wrote: You can check for texture effects (preferred orientation) by obtaining multiple patterns of the material. It's realistic to expect some differences, but preferred orientat

Re: B3+

2025-03-20 Thread Luca Lutterotti
Nope, I checked what I have and I use Xraylib now in Maud but also there is only B neutral. Maybe someone can calculate them? Ciao Luca <http://www.unitn.it/> Luca Lutterotti Dipartimento di Ingegneria Industriale Università di Trento via Sommarive, 9 - 38123 Trento (Italy) tel. +3