« previous next »
Pages: [1]   Go Down

Author Topic: Non-equilibrium momentum exchange simulation  (Read 7578 times)

0 Members and 1 Guest are viewing this topic.

Offline malay srivastava

  • Regular QuantumATK user
  • **
  • Posts: 6
  • Country: in
  • Reputation: 0
    • View Profile
Non-equilibrium momentum exchange simulation
« on: March 5, 2021, 01:22 »
In Setting up the non-equilibrium momentum exchange simulation, there is no option for selection of Zmin or Zmax. I am using 2019.12 version. For calculating Temperature gradient, Zmin, Zmax selection is required. Any suggestions , please?
Logged

Offline mlee

  • QuantumATK Guru
  • ****
  • Posts: 173
  • Country: dk
  • Reputation: 7
    • View Profile
Re: Non-equilibrium momentum exchange simulation
« Reply #1 on: March 5, 2021, 05:59 »
Recent version has been changed in Zmin and Zmax because you can use several plot fitting methods in the plot editor. See the plot edit in the below part of the graph.
Logged

Offline malay srivastava

  • Regular QuantumATK user
  • **
  • Posts: 6
  • Country: in
  • Reputation: 0
    • View Profile
Re: Non-equilibrium momentum exchange simulation
« Reply #2 on: March 5, 2021, 12:48 »
Sir, I cannot find a plot edit. please find the attachment. Edit plot does not have the option to get the gradient. Also, how to export the data to text file from MD analyzer.
« Last Edit: March 5, 2021, 12:55 by malay srivastava »
Logged

Offline mlee

  • QuantumATK Guru
  • ****
  • Posts: 173
  • Country: dk
  • Reputation: 7
    • View Profile
Re: Non-equilibrium momentum exchange simulation
« Reply #3 on: March 5, 2021, 13:14 »
When you click the c-axis in Temperature Profile of the Edit Plot, the center of 3 icons in the below part will be active. You can use several fitting methods of the plot.
« Last Edit: March 5, 2021, 15:27 by mlee »
Logged
Pages: [1]   Go Up
« previous next »