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jurassicbunny's Projects

ezaimd icon ezaimd

Command line tool that allows the user to easly run ab initio molecular dynamics (AIMD) interfacing with the Gaussian16 quantum chemical package.

rgaussian16 icon rgaussian16

rust library which can gernerate input for the Gaussian16 quantum chemical package

rust_vec icon rust_vec

A bare bones vector struct for working in three dimensions.

vectored icon vectored

Wrapper around the Eigen::Vector3d class. Allows for more declarative and type safe programing when three dimensional vectored quantities are required.

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