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Q: What is the rate constant for this reaction?

Yazan TFSThe reactant concentration in a zero-order reaction was 7.00×10−2 mol L−1mol L−1 after 180 ss and 2.00×10−2 mol L−1mol L−1 after 345 ss. What is the rate constant for this reaction? [1]: https://i.stack.imgur.com/qMZyU.png

chemistry
 
 
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r/comp_chem
r/comp_chem
9:50 AM
Computational Chemistry: How to use user defined potential in Lammps ?
posted on January 14, 2022 by /u/go2souvik

I want to use a potential of the form which is not available in lammps. I know that we can use the command potential style 'table' to use my desired potential. But I couldn't able to use it in my .in file. Could anyone please help me providing a script of NVT simulation in lammps using a user defined potential. For the time being, you can assume LJ is not defined lammps and you want…

 

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