I keen to learn Rietveld Refinement using Fullproof.
If you have any type of information share with me.
Thank you.
I would like to do first principle studies(using DFT) for this technique to compare experimental and theoretical value. Thank you.
09 October 2014 1,795 3 View
I am good at DOS, Band structure and phonon studies. I would like to extend my studies to Dielectric and Ferroelectric studies. How to find the polarization in the material?
07 August 2014 10,060 5 View
I would like to do refinement. Could you suggest me which one is better? Thank you.
06 July 2014 7,753 5 View
What is the good software for nonlinear curve fitting rather than Excel and Origin?
04 May 2014 9,179 10 View
I want to attend DFT summer schools. If anyone knows please let me know the details. Is there any website for DFT related schools?
02 March 2014 9,989 0 View
My material band gap is 2.86 eV. I am confused as to how to confirm whether it is a Insulator or Semiconductor. In literature it has not been made clear.
01 February 2014 10,028 10 View
I am new to this area. I would like to study these concepts from beginning onwards.
11 December 2013 3,591 9 View
Is there any free software to find Raman theoretical modes? I know Gaussian 3 package but it is a licensed version.
10 November 2013 567 3 View
How to find the vibrational frequencies using Pwscf? I have taken Experimental Raman spectrum. I have to assign the modes (A1g, B1u,B2g and A2g etc) for each peak in spectrum. Example given below.
10 November 2013 6,037 25 View
I would like to know the ferroelectric perovskites names and their spontaneous polarization.Could you suggest me any book or website?
10 November 2013 1,543 7 View
I would like to learn more about SPSS and Its application especially in regards to data analysis. Please suggest me how I can learn more about it. Thank you so much.
11 August 2024 9,101 4 View
I have reverse sequences (AB1 format), can I base on reverse DNA sequences to perform nucleotide alignment, convert nucleotides to amino acids and deposit the sequence in GenBank database?
11 August 2024 5,138 1 View
Hello, Why do i see this baseline drift when i compare my blank (black) to the sample (blue)? Any suggestions as to why this happened? Thank you!
11 August 2024 3,770 4 View
Willett, Shenoy et al. (2021) have developed a brain computer interface (BCI) that used neural signal collected from the hand area of the motor cortex (area M1) of a paralyzed patient. The...
10 August 2024 7,180 0 View
I'm currently exploring the application of Python in textile engineering, specifically in areas like data analysis, process automation, and the development of smart textiles. I'm interested in...
10 August 2024 7,429 2 View
How can I use the cif data obtained from rietveld refinement extracted via gsas2, for microstructural analysis using ETEX software?
09 August 2024 7,718 0 View
Require for Rietveld refinement in XRD.
08 August 2024 3,081 2 View
Let's say we have a standard, regular hexagonal honeycomb with a 3-arm primitive unit cell (something like the figure attached; the figure is only representative and not drawn to scale). The...
07 August 2024 1,937 1 View
A fungal strain was treated with nanoparticles. We want to do an environmental SEM analysis. So could anyone share your views on preparing the sample? Thank you.
07 August 2024 5,307 1 View
Hi, I have a question about normalizing the MTT OD values for doing the statistical analysis. So, if we have 3 different plates and we call them 3 different replicates, so, first we would...
07 August 2024 8,106 4 View