11 Questions 7 Answers 0 Followers
Questions related from Arslan Ullah
Question: is it possible to propose the exect picture of defect dynamics in a material say SiC without considering charge transfer mechanisms during this and only considering the thermodynamics...
14 June 2022 5,520 0 View
I want to understand how the symmetry of defects play the role in the quantum applicaitons. Because, implementation of nano-photonics structures in the vicinity of spin-based quantum systems...
29 December 2021 3,997 0 View
this method is used to map open spaces and for further investigations accordingly. why we use this ?
25 December 2021 2,210 2 View
I am trying to run a simple Geometry optimization on a 6-core machine, whenever i try to run the simulation it shows this error. "Open MPI tried to fork a new process via the "execve" system call...
08 January 2021 3,124 0 View
I want to know the simple exact and easy to understand scientific logic of the phenomenon involved for the water dissociation in the photo catalytic cell. Regards
06 January 2019 4,552 4 View
optimization in the given structure is showing problem as this elongated adsorbent on the small surface is not making a perfectly repeated unit cell, can I increased the value of lattice...
11 November 2018 5,338 5 View
we are trying to use different new families of material for Li ion battery cathode, I want to know the clear differences that determine a material to be used as cathode or anode for Li ion battery...
05 September 2018 8,571 6 View
I Want to simulate the nano tube by coordinates but it seems hard , can any one help me out in this.
01 January 1970 5,659 3 View
I want to now the Cauchy stress tensor for movement of ions in a material, just like the moving of Li ions in Battery cathode material.
01 January 1970 1,207 2 View
hello everyone I am studying defect formation barriers by diffusing the atom to vacancy site.I am facing a problem of 0 reverse energy barrier EBR (indicating the diffusion of atom to high energy...
01 January 1970 3,188 1 View
I am done with masters in computational materials. I want to switch my field with quantum computing ? I need recommendations from the scientific community. I am aware of the fact it would be...
01 January 1970 4,515 3 View