Has anyone calculate the NMR shifts using WIEN2K code?
Are you using the new NMR module?
http://www.mail-archive.com/[email protected]/msg10108.html
Thanks. For the link prof. Moris
http://s2.picofile.com/file/7571628816/MestReC.exe.html go to this link and click on red link and download this software.
Thanks Dr. Jahed
The political participation of the Kirat Rai community in Nepal has evolved significantly over time: Historical Context Historically, the Kirat Rai people, like many indigenous groups in Nepal,...
05 August 2024 5,950 1 View
I am doing a comparative study in which I will check the patient's progress by assessing their gait parameter, and to do that I will be using the abovementioned software. Still, before that, I...
17 July 2024 6,551 2 View
Allometric equations are available for trees but couldn't find any method/equation for ornamental plants?
04 July 2024 2,646 1 View
Hello, I got reviver comment " please look into the comparative assessments regarding Ki (inhibition constant); Kd (dissociation constant), and Km "equilibrium constant" of the target...
09 June 2024 10,069 3 View
It is a sponsored project to develop a gasket made up of FGM material and validate the nonlinear behavior of the FGM using Abaqus simulation. I was exploring the behavior of the gasket element...
25 May 2024 2,407 0 View
Such as H phase MoS2 and VS2 show same raman peaks.
08 May 2024 4,379 3 View
Sci finder helps to find out the research that has published.
30 April 2024 6,287 0 View
Design constraints such as strength requirements, and size limitations are to be considered while designing winglet
26 April 2024 6,857 2 View
I need the crystallinity percentage value of crosslinked polyethylene (PEX-A). I know that they have more than 70% crosslinking. Is there any way to calculate the crystallinity percentage from...
22 April 2024 3,007 0 View
Hi all, I encountered an error while running SCF with SOC+U using Quantum Espresso 7.3. Here is the error%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%% Error...
09 March 2024 9,104 4 View
I need to model an anisotropic material in which the Poisson's ratio ν_12 ≠ ν_21 and so on. Therefore, the elastic compliance matrix wouldn't be a symmetric one. In ANSYS APDL, for TB,ANEL...
09 August 2024 5,047 2 View
Request Python code from this article : Gender equity of authorship in pulmonary medicine over the past decade. THANKS!
08 August 2024 6,242 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 1,936 1 View
Hi, I'm currently working on a project where I need to plot the atom-projected band structure using GPAW. I've been able to calculate the band structure for my material, but I'm having trouble...
07 August 2024 266 3 View
Visual Studio Code (VS Code) has become a popular choice among developers for several reasons: 1. **Free and Open Source**: VS Code is free to use and open source, making it accessible to...
07 August 2024 7,012 4 View
I need the python code to forecast what crop production will be in the next decade considering climate and crop production variables as seen in the attached.csv file.
05 August 2024 2,976 3 View
I am using a Bruker 600M solid-state NMR spectrometer with a Micro 2.5 microimaging system. The test sample is a tube of 1M LiCl aqueous solution, and the nucleus detected is 1H. I am trying to...
01 August 2024 9,225 1 View
We are looking for projects for a team of professional developers About us We are a team of experienced developers with over 10 years of experience in various programming fields. Our mission is to...
30 July 2024 8,376 0 View
I'm using a InVia Renishaw Raman microscope system (785nm wavelength, 600l/mm grating density) to acquire Raman images on human brain samples, at 50um resolution. The samples are placed on MgF2...
30 July 2024 8,770 3 View
Dear all: I am modifying Bismuth Tungstate with Hematite (Fe2O3), so I would like to know about how much Iron(+3) can form a solid solution in a Bismuth Oxide matrix. Best wishes Marco
29 July 2024 2,161 1 View