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ashfaqadnan's blog

Mechanical Properties and Lattice Structure of Single Crystal 3C-SiC

Submitted by ashfaqadnan on

Hi,

I truly appriciate if anyone can help me find mechanical properties and crystal structure of beta SiC single crystals. Any reference or link will be highly appriciated

Sincerely,

-Ashfaq Adnan

Natural Frequencies for all elements in the Periodic table.

Submitted by ashfaqadnan on

Hi, 

I am interested to know the natural frequencies of elements in the periodic table. I made some attempt to reveal this information but surprisingly ended with nothing. Perhaps I  did not search hard. Does anyone know about the natural frequencies of elements in periodic table.

 

Sincerely,

-Ashfaq Adnan

Doctoral Candidate, School of Aero and Astro, Purdue University, Indiana

 

Why larger time step is not allowed in Molecular Dynamics Simulation?

Submitted by ashfaqadnan on

Hi, 

I am trying to understand why MD simulation crashes if larger time step (~100 fs) is applied to integrate the equation of motion. I know that there are two major things play role in solving F = ma and obtaining equilibrium solution. One is the accuracy, and the other is numerical stability of the integration algorithm.