26 lines
1.0 KiB
Markdown
26 lines
1.0 KiB
Markdown
# lj_monte_carlo
|
|
Simple Lennard Jones Liquid MC simulation implemented in Rust
|
|
|
|
To compile, run:
|
|
```
|
|
// release builds are much faster because of enabled lto
|
|
cargo build --release
|
|
```
|
|
|
|
The compiled binary can then be found in ```target/release.```
|
|
|
|
# Phase diagram of a 6-12 lj fluid
|
|
(cutoff rc of 3.5 sigma)
|
|

|
|
Source: Ge J. et ak., Scaling behavior for a pressure and energy of shearing fluids. Phys Rev 061201, p. 67-68, 2003
|
|
|
|
|
|
# Results
|
|
Some results obtained during the creation of this project
|
|
|
|
|
|

|
|
Function of state at different temperatures. 512 particles were simulated with applied potential shift and tailcorrection. Displacement scaled to have 33% acceptance rate during 1mio steps. Averages over 100k steps.
|
|
|
|

|