In step potential what will happen if E= V . means R = 1and T =0, but what about second region wave function..it will be what??
p4vasp provides better bond cut structure than any other software I know. Is there any possible way that I can change atom colors as well. Specific color would be great to make better structures.
01 February 2017 4,803 0 View
Can anybody suggest some good simulation package to do Non Adiabatic Quantum Molecular Dynamics (NA-QMD). These packages are very much helpful to understand photo voltaic properties of materials .
07 August 2016 5,276 4 View
Error reading item 'MAGMOM' from file INCAR. Error code was IERR=0 ... . Found N= 2 data I am getting this error in VASP while running job . Can anyone help
02 March 2015 6,369 2 View
Which Software would e good fro making 3D schematic . I tried many like illustator or
31 December 2014 6,844 3 View
Can anyone tell me how to generate an Input File and Potential? I am not able to generate a 2d data file and I and also not sure how to use it and the Potential file .
11 December 2014 515 5 View
Why strain change band structure? When we apply any strain on any unit cell of any material which is not centrosymmetric why band structure get change . And in case of SOC also
09 October 2014 1,655 5 View
Does any body can teach me through skype or any way lammps coz that lammps manual on the website is not helping me very much so i need some help.. Any one have their personal manual can provide me?
08 September 2014 4,128 0 View
What Is Gaussian smearing and Fermi smearing.?
08 September 2014 9,905 3 View
Why XRD is used when Neutron and Electron Diffraction can be also used for Lattice Structure? Neutron particle also has a small wavelenght compare to 1 A0 . Or Electron diifraction?
07 August 2014 10,057 16 View
Where both of the same group element and as well KCl also has structure as NaCl?
07 August 2014 2,118 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
Does anyone know of a module for the JAMOVI software that is capable of generating mean separations using the classic letters based on post hoc results (e.g., Tukey test)? If, as I believe, such...
31 July 2024 3,333 4 View
I have found an EEG where only alpha waves are present. Beta waves are not found in active patients. What interpretations ?
26 July 2024 4,741 1 View
Photo-electric effect A light particle moving towards a surface cannot (by collision) force an electron particle to move away from that surface. A light wave can instead make interference with a...
19 July 2024 8,389 9 View
I am currently working on a mendelian randomization study, and I have downloaded the datasets needed from the ieu opengwas project (mrcieu.ac.uk) in .vcf format. I do not have access to an R...
19 July 2024 2,342 5 View
One of the papers I read by Toby, where (title of the paper was "R factors in Rietveld analysis: How good is good enough?"), he tells us that to get good chi square value, you must have low Rwp,...
17 July 2024 9,668 4 View
Let n∈ℕ, where the function f:A⊆ℝ𝑛→ℝ, 𝐴 is Borel, and (A,d) is a completely seperable space. What is the name of the functions where the graph of f in any (n+1)-dimensional box of A×ℝ is...
17 July 2024 258 1 View
I want to develop the figure like attached figure. How can I get, peak period and significant wave height at any given location.
13 July 2024 886 2 View
Hi, I am trying to simulate a ship in a canal. The top width of the canal is 20m, bottom width is 6m, depth is less than 5m. Ship has a length of 11.7m breadth of 4m, draft is 0.62m. The velocity...
10 July 2024 1,732 4 View
We have developed an ODE model comprising 25 interrelated equations with common coefficients. This biochemical model, applied in wastewater treatment, is characterized by stiffness. Utilizing the...
06 July 2024 7,077 4 View