Tirimisiyu Olaniyan

5 Questions 3 Answers 0 Followers

Questions related from Tirimisiyu Olaniyan

Pair Style of LAMMPS Code?

Dear All, Kindly assist me with a hybrid command to run my model. I model water molecules using code I got from LAMMPS documentation (TIP4P water model). After, this I used Ovito to insert the...

01 April 2024 3,223 0 View

What is wrong with Hydrostatic stress calculated vai LAMMPS compute stress/atom commands?

Kindly assist with my challenge. I used stress/atom commands in LAMMPS to calculate Von miss stress and hydrostatic stress of a silicon nanometric cutting. Unfortunately or fortunately I got...

30 March 2024 7,087 2 View

Change of crystal structure (nanocutting)?

I made a workpiece via Atomsk and get the sharp tool in Ovito (tool with edge radius: I used comsol with stl file and put atoms using Atomsk. Before combining the tool and workpiece, diamond cubic...

13 March 2024 4,019 0 View

How to insert water molecule into a machining model and set the potentials?

I have the model as attached. I want to have a simulation box containing water molecules to mimick fluid in the simulation. The other image shows TIP3P water addedd to the system. I am new in MD...

02 February 2024 3,097 1 View

What is the way forward about Machining Atomistic modelling?

I am PhD research student at a university in Scotland. I am in my first year with background in Materials and Metallurgy. I want to go into simulation particularly MD. My proposal research is on...

08 October 2021 357 2 View