Seyed Faridedin Rafie

4 Questions 4 Answers 0 Followers

Questions related from Seyed Faridedin Rafie

How can I set periodic boundary conditions in VMD for a box that starts from negative coordinates?

Hi all, I'm currently working with a simulation in VMD where my system's box starts from negative coordinates (e.g., x = -0.5, y = -0.5, z = -10.5) instead of starting at zero. I'm trying to...

02 March 2025 1,258 1 View

Will coating the photocatalyst agent lead to a decrease in its efficiency?

Hello everyone, I have a question regarding the utilization of photocatalysts in water treatment. Will coating the photocatalyst agent lead to a decrease in its efficiency? Thank you!

21 March 2024 8,735 1 View

How can I provide NixCo(1-x)Fe2O4 (x=0.25, 0.5, and 0.75) molecular structure using for molecular dynamics simulations?

In the internet, cobalt ferrite and nickel ferrite can be found alone, but not nickel-cobalt spinel ferrite. #molecular_dynamics_simulations #lammps #molecular_structure #ferrite_spinel

02 April 2023 993 2 View

If the correlation coefficients (R2) of adsorption isotherms Langmuir and Freundlich are very close together (0.98 and 0.99), what does this mean?

How can I interpret?

29 March 2023 5,303 8 View