CHANGELOG.md
CITATION.cff
CONTRIBUTING.md
INSTALL.md
LICENSE
MANIFEST.in
README.md
THIRD_PARTY_NOTICES.md
pyproject.toml
LICENSES/Apache-2.0.txt
examples/README.md
examples/lln_low_temperature_demo.py
examples/mlip/MgO.cif
examples/mlip/README.md
examples/mlip/pe_cell.vasp
examples/mlip/pmma_glass.vasp
examples/mlip/zro2_BORN
examples/mlip/zro2_cell.vasp
examples/spectra/README.md
examples/spectra/graphite_arcs_map.yaml
examples/spectra/graphite_direct_qcuts.yaml
examples/spectra/graphite_mode0_dosfile.yaml
examples/spectra/graphite_mode0_phonopy.yaml
examples/spectra/graphite_mode2_vision.yaml
examples/spectra/data/graphite_C_dos.txt
examples/tsl/README.md
examples/tsl/be_iel10_extinction.input
examples/tsl/graphite_iel10_classic.input
examples/tsl/graphite_mode2.input
irma/__init__.py
irma/__main__.py
irma/cli.py
irma.egg-info/PKG-INFO
irma.egg-info/SOURCES.txt
irma.egg-info/dependency_links.txt
irma.egg-info/entry_points.txt
irma.egg-info/requires.txt
irma.egg-info/top_level.txt
irma/core/__init__.py
irma/core/constants.py
irma/core/crystal.py
irma/core/crystal_cards.py
irma/core/crystal_input.py
irma/core/deck.py
irma/core/driver.py
irma/core/elastic_dw.py
irma/core/elastic_extinction.py
irma/core/endf_writer.py
irma/core/engine.py
irma/core/extinction.py
irma/core/grids.py
irma/core/incoherent_dw.py
irma/core/kernels.py
irma/core/noncubic_engine.py
irma/core/noncubic_helpers.py
irma/core/noncubic_inelastic.py
irma/core/noncubic_inelastic_context.py
irma/core/noncubic_numerics.py
irma/core/noncubic_workers.py
irma/core/nuclear_data.py
irma/core/phonopy_io.py
irma/core/sab_grids.py
irma/core/standalone_sab.py
irma/gui/__init__.py
irma/gui/app.py
irma/gui/deck_text.py
irma/gui/element_table.py
irma/gui/endf_form.py
irma/gui/grid_form.py
irma/gui/mlip_panel.py
irma/gui/ncrystal_panel.py
irma/gui/ns_panel.py
irma/gui/runner.py
irma/gui/widgets.py
irma/mlip/__init__.py
irma/mlip/bundle.py
irma/mlip/calculators.py
irma/mlip/cli.py
irma/mlip/emit.py
irma/mlip/envs.py
irma/mlip/force_server.py
irma/mlip/phonons.py
irma/mlip/relax.py
irma/ncrystal/__init__.py
irma/ncrystal/__main__.py
irma/ncrystal/build.py
irma/ncrystal/config.py
irma/ncrystal/convert.py
irma/ncrystal/ncmat.py
irma/ncrystal/pack.py
irma/ncrystal/provenance.py
irma/spectra/__init__.py
irma/spectra/__main__.py
irma/spectra/chopper_resolution.py
irma/spectra/cli.py
irma/spectra/config.py
irma/spectra/dos_from_phonopy.py
irma/spectra/dos_io.py
irma/spectra/dos_mode0.py
irma/spectra/elastic.py
irma/spectra/forward.py
irma/spectra/instruments.py
irma/spectra/sqe.py
tests/mode2_euphonic_n1_validation/graphite/FORCE_CONSTANTS
tests/mode2_euphonic_n1_validation/graphite/phonopy.yaml
tests/native_LEAPR_NJOY_ENDF_validation/leapr_to_irma_input.py
tests/native_LEAPR_NJOY_ENDF_validation/leapr_decks/tsl-013_Al_027.input
tests/native_LEAPR_NJOY_ENDF_validation/leapr_decks/tsl-026_Fe_056.input
tests/native_LEAPR_NJOY_ENDF_validation/leapr_decks/tsl-BeO.input
tests/native_LEAPR_NJOY_ENDF_validation/leapr_decks/tsl-HinCH2.input
tests/native_LEAPR_NJOY_ENDF_validation/leapr_decks/tsl-crystalline-graphite.input
tests/native_LEAPR_NJOY_ENDF_validation/leapr_decks/tsl-l-CH4.input
tests/native_LEAPR_NJOY_ENDF_validation/leapr_decks/tsl-ortho-H.input
tests/native_LEAPR_NJOY_ENDF_validation/leapr_decks/tsl-para-H.input