Topic: vibrational-spectroscopy Goto Github
Some thing interesting about vibrational-spectroscopy
Some thing interesting about vibrational-spectroscopy
vibrational-spectroscopy,Python package that provides a full range of functionality to process and analyze vibrational spectra (Raman, SERS, FTIR, etc.).
User: alebrun-108
vibrational-spectroscopy,Procedures (for IgorPro) to perform operations needed in day to day analysis of spectroscopic data. For example, Raman or infrared spectra where the data is structured as array of 1-D or 2-D waves.
User: ankit7540
vibrational-spectroscopy,Automated all-functionals infrared and Raman spectra, and phonons.
User: bastonero
Home Page: https://aiida-vibroscopy.readthedocs.io/en/latest/
vibrational-spectroscopy,Python tools for localizing normal modes
User: chjacob-tubs
vibrational-spectroscopy,Vibrations - a Python Code for Anharmonic Theoretical Vibrational Spectroscopy
User: chjacob-tubs
vibrational-spectroscopy,Simulates the vibrational spectra of organic molecules such as amino acids, peptides, or nucleic acids using PyVib2's vibrational perturbation theory algorithm with a DFT potential energy surface. Analyzes the vibrational spectra and investigates the effects of different functional groups and conformations.
User: edwardcalzia
vibrational-spectroscopy,The Solvshift Project (SLV)
User: globulion
vibrational-spectroscopy,Python package for working with spectral data
Organization: ibcp
vibrational-spectroscopy,Jupyter notebooks for probabilistic modelling of vibrational spectroscopic datasets
User: jnispen
vibrational-spectroscopy,This is a code for generating empirical maps from molecular dynamics simulations (and electronic structure calculations).
User: piskuliche
vibrational-spectroscopy,A PyMOL plugin for visualizing vibrations in molecules and solids
User: smutao
Home Page: https://sites.smu.edu/dedman/catco/publications/pdf/434.pdf
vibrational-spectroscopy,SI documentation for the journal article entitled, "Exploring the anharmonic vibrational structure of CO2 trimers."
Organization: sodelab
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