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1. LAMMPS LAMMPS Public

   A suite of codes to aid users create LAMMPS input files, to be used in conjuction with https://github.com/agiliopadua/fftool

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2. FMO-PIEDA FMO-PIEDA Public

   *Under Construction* A suite of codes to perform PIEDA analysis using FMO in GAMESS.

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3. ILDatabases ILDatabases Public

   Geometries of ionic liquid databases for method validation

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4. psi4 psi4 Public

   Forked from psi4/psi4

   Open-Source Quantum Chemistry – an electronic structure package in C++ driven by Python

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5. MD-FreeVolume-Code MD-FreeVolume-Code Public

   This repository contains code to calculate the free volume of trajectories obtained from LAMMPS software

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6. DeltaML-DFT DeltaML-DFT Public

   Files to accompany the submitted manuscript of Delta-ML DFT models created in the Monash Computational Chemistry Group