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Hi Sam, Thanks for the comments. I only tested the code under MMA 9.0 and 10, as I do not have 10.1 near hand. Any improvement on the code and algorithm is welcomed. The Github linkage is: https://github.com/sunbc0120/Raiden I was born at... |
![Directive observation to the ensemble energy profile, which makes it possible to determine whether the simulation cycle and trial numbers are sufficient for the system to reach equilibrium][1] In the famous book "[Understanding Molecular... |
There is a cool demonstration project [here][1] showing the ideal gas law $$PV=nRT$$ where $P$ is the pressure, $V$ is the volume, $n$ is the amount of gas, $R$ is the gas constant, and $T$ is the temperature of the gas. Just want it to be... |