5 skills found
deepanshs / MrsimulatorA fast solid-state NMR spectrum simulation and analysis library.
rinikerlab / EquivariantMultipoleGNNEquivariant GNN for the prediction of atomic multipoles up to quadrupoles.
ShenXiaoxue / Acoustic SourcesAdd BC on the surface of embedded mesh to simulate acoustic sources, like plane wave, monopole, dipoles, quadrupoles.
dragozzine / Multimoonfit solar system small body multiple systems with non-Keplerian orbits including quadrupole shapes
bennomeier / SpindataSpindata provides the gyromagnetic ratio, spin and quadrupole moments of nuclei as needed in Nuclear Magnetic Resonance.
