Nicholas Hestand

@nicholashestand · User

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Springfield, MO33 followers16 repositories

Repositories

nicholashestand/exciton1d

Repository containing program to calculate the absorption spectrum and band dispersion of 1D aggregates.

★ 8FortranForks 8

nicholashestand/calcIR

Calculate IR Spectra of Water from MD simulation using the maps developed by Jim Skinner's group.

★ 0CudaForks 0

nicholashestand/exciton_para

Repository containing utility programs to help parameterize the Holstein Hamiltonian used in the Repositories exciton1d and exciton1d_td from ab-inito Gaussian09 calculations.

★ 4FortranForks 2

nicholashestand/calcIR2

This repository contains a program to calculate the IR spectroscopy of dilute HOD in D2O or H2O.

★ 0C++Forks 1

nicholashestand/JansenIR

This repository contains a program to calculate the IR spectroscopy of water using the maps from Jim Skinner's group.

★ 0CForks 1

nicholashestand/csvPlot

A python utility script built on matplotlib to quickly plot data files from the command line.

★ 0PythonForks 1

nicholashestand/exciton1d_td

Repository containing program to calculate the exciton trajectory in 1D aggregates where both Couombic and charge-transfer interactions are present.

★ 0FortranForks 1