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github.com/radis/radis
🌱 A fast line-by-line code for high-resolution infrared molecular spectra
https://github.com/radis/radis
c6a8ecf0326661080143ffccb26154b64bcb4328 authored over 3 years ago
03ad85ac35488c7796c70d73f54e17fa8a7e0c77 authored over 3 years ago
9307db366ae39e298e2bfa0e9c38c07682e7aa9c authored over 3 years ago
24f574d81849c04604f0b4342eb40492b798f5cb authored over 3 years ago
f01697ff99778921f2b3a831e1bea98794fac387 authored over 3 years ago
ensure overall accuracy is 1% | reduces memory of the grid by x10 with 3 Tvib
a6cb971c743874d149657f7e216f35498bf34606 authored over 3 years agoFix/misc docs, examples & imports
74c9883d0063060a3bca799a0753eb03b2312b3a authored over 3 years ago91668575869635fd3aa5fb911d672bd72262cace authored over 3 years ago
(saves 2s on import. check with code of https://github.com/radis/radis/pull/309)
8305020a2008e33b1ae7b38e876fe7ecded4cd52 authored over 3 years agohttps://lgtm.com/projects/g/radis/radis/snapshot/5b0275caad53176177d2e7d3e9580d4900f4527e/files/r...
e498608a30b78e0e9cf1c407106abaea10e96486 authored over 3 years ago017eb9027d28517f27deac5382a6d909fb8abf2b authored over 3 years ago
Update fitting functions, add new example, update fitting models
b06347a36abf36bae54660a70f3f2c1c560467ad authored over 3 years agoce26cc1444fcfbdca87bfb6cae878a023e697a7d authored over 3 years ago
Add fixed parameters directly in the model (slowly converging to a framework closer to Astropy...
4dc8f64223c006ca9f2077d58bcf6fc9ec92eb65 authored over 3 years ago19857b169e2895a61985480c0cd786803d6736d5 authored over 3 years ago
f57bb8436d409c5b43120b765a9b89721e2a2fef authored over 3 years ago
ef47b76cf7571525ed92d08bd11f13005411dbcd authored over 3 years ago
ec5ced9f91fde71886d988bb58c55b94dffe41b8 authored over 3 years ago
improve multi-T fitting example
8ed6a2be8ea1484ca8dff220b90f8841c84a1997 authored over 3 years agofix wunit problem in fitting()
remove some warnings & verbose shown during the fitting process
57c2b62c3bb80816599a8ef29f5e5edbdc85b33f authored over 3 years ago
3ad4654e9244136b55b6a8316151bb49e78f996b authored over 3 years ago
add examples, mention chaining, update docs
f1378b0e9500c9ca8b1a35fee3a2478a4310dda5 authored over 3 years agocb7a28d02c87d57f47a2e87cf30306cf769312a3 authored over 3 years ago
3f609c916671c847c9ab7d208f64c3e1c55c6288 authored over 3 years ago
c0fb6d3f5edfc9b3a81bd20104ac97e456f3f026 authored over 3 years ago
f1ffb2e7649552a01dd8b84c18cc8da33b795190 authored over 3 years ago
Fix/doc api
781fb5282f7cf151aef8efbafc17c7da2ded2ae8 authored over 3 years ago42c498f399bfb523362aa16146d008a4e3afc762 authored over 3 years ago
Add fit spectrum method
75077b3d724a2d7b8592302f5c4c101182089f12 authored over 3 years agod27ed3db82670489ca1751cafc4258892e19ec83 authored over 3 years ago
add just-in-time tabulation of calculated (eq/non-LTE) partition functions
b310116c9cdd7c8a1ad2ac819ba54c57ee033220 authored over 3 years agofix tests
7641e157b78acab0af8f0df34ad5fcd761947ab4 authored over 3 years agocc1f7287243bbccafee4a05bcba6014ac261e027 authored over 3 years ago
058ee2f6e7aae736914b3e67c23b326af7b5f737 authored over 3 years ago
simplify syntax of Q() calculation with/without isotopes with the map(dict) approach
77b871ec90e6b009433b4addb6d8dc9a66dd1007 authored over 3 years ago(misc) update test_population with pytest.raises syntax
0843c03f40278f31d16d82157a03d4f480ff7d06 authored over 3 years agosorted problem in test_populations
6c85a9ef0c3165b12c85688d9a60dd8b8bd27dff authored over 3 years agoadd a test comparing 2 spectra computed with full-summation and tabulation
(misc) re-add :hardcod...
0b2bc4dcc4de91d78e11e7c7f70d86ae264aafec authored over 3 years ago
9e07cd3cbb32c7d8a2f39ff2484e4bd7eb81f849 authored over 3 years ago
eec394c5bae55476fadc408863c333e476a04ad1 authored over 3 years ago
new parameter : SpectrumFactory.misc.export_rovib_fraction to choose whether to compute nu_vib, n...
4b443b0b361638e6c0c8b8e75c7f9d7b1049017c authored over 3 years ago5926592e5a04818b0dd34a8bc1eb227ca96b8db7 authored over 3 years ago
- choosing mode='tabulation' or (still default) mode='full summation'
'tabulation' is ~3500x fa...
e84272da7ea45d70e9e33a8dc77ed52340a83955 authored over 3 years ago
230dc028898e471d921d1ac15c73726817707c65 authored over 3 years ago
0cafb0aeffb444d0f2696be21912e6ef4500169a authored over 3 years ago
6f4725b398533989b71e71e983d79ddc8bab250c authored over 3 years ago
more links
fix a circular import
Add exomol support
9c290e7b8cfe46ed1d0f629f4e4a6b05054b3ec9 authored over 3 years ago5322c4973ba7ba6cf053bae74fabbfd63b450eed authored over 3 years ago
0fa5520506bb36df1c02557f5df18be16cd2a1df authored over 3 years ago
02c4acd5df5573205a84c8a75ed5af284bbf8374 authored over 3 years ago
b6ce2fae9df15a273078223137e8dd8c8f44557e authored over 3 years ago
b4bdba5a5bbb5a0943d7943f79631821b463736c authored over 3 years ago
f41144e425f84041f9b6f310f83525b2747fbf75 authored over 3 years ago
extra tests
7dd2599e41c8fde62860e690df7b9afdb7857194 authored over 3 years ago- allow calc_spectrum(..., databank='exomol') syntax
- use partition functions downloaded from Ex...
fix some LGTM warnings
018537df0b8e0d0123a8ee58558e3645e4a093b8 authored over 3 years ago(could be optional and for sure improved in term of memory)
85e943392fd39a9cad91ccfaf45188ab0f12a985 authored over 3 years ago6791262ced841db5c50f5cda7c414dc6d2dbda87 authored over 3 years ago
da68b26f96106dd71864d3f0295ba45a691fdcdb authored over 3 years ago
simplified code and removed useless chunks introduced to deal with multi-molecules (NotImplemented)
1771df15b3b32053145adb8b0cf50f65c1f4a50a authored over 3 years agoincluded j_low in df0
5c1014999977ea2fb7a2822a3f45b3e19e6301b6 authored over 3 years agoadded small test
a6e304f9c6f82595fe06d4f1c6c084f31783be1f authored over 3 years agoRemoved the warnings
a37de7184afe3458a2fd8f2544981fb220ec8a1b authored over 3 years agoalso reduced memory usage by loading only "K" (temporary)
64226a004723a531d75a728e9d4b212b44609879 authored over 3 years agoadded raise if partfun or database is ExoMol but not both
57b0e11af36cb8755885955340370613106bfe47 authored over 3 years ago3851a508bbfede580580346e876c1cca3afb2bc9 authored over 3 years ago
bda5eb170740c6fd750dc309f5a50f4b0e52eebe authored over 3 years ago
add parsing tests
update supported molecules with some extra molecules not in HITRAN (so far: FeH)
03c8c7c87933704d65721a32542e9c09f89b853c authored over 3 years ago
- add new warnings where Pressure Lineshift or Resonant broadening missing from database
- conver...
fdc92e840cc8cda3431dfea6a8efa0bf16477a62 authored over 3 years ago
ce37d8477dff014a9b77556e8af73f329e2eb2fa authored over 3 years ago
b5cd01d41b16ab1b1941b989e4f775ba0ecb6a4d authored over 3 years ago
3945c476f2e4a800d1a2c6c0e300a5837b5e37bd authored over 3 years ago
Fix docs warnings, links in examples, and proper imports
d91d7fdb5ccb4249335da57396b5686b7ace6398 authored over 3 years agoff136b856ab166096fd527946a155637fc41f934 authored over 3 years ago
fixes mapping of references to functions & methods in examples ; probably helps IDE completion too
dc553f832b9e17e74f492b17cc1550d2b9513717 authored over 3 years agoimprove docs
aa50a5b569bc560489312132a3d6472d7cb2ab10 authored over 3 years agof3187073d7d8afaf1906397852512ebb7c0054e7 authored over 3 years ago
Appends calculation time if same key/step is executed
abc587493666a1f88e0310e620d3e841e3bd383f authored over 3 years agoed567a751f737c0628bf9f9c6f9e93557529b69d authored over 3 years ago
7b8c25fae95c5f27634e9ad71f55797145cc33be authored over 3 years ago
9422f1f34f83335daf1f2a02ace73ea47ef43de3 authored over 3 years ago
new profiler + use tuna 🐟 to generate visual/interactive performance profiles
142bb9f9c6beccd57f408fa43c18544d8f4c3884 authored over 3 years agobaad16208643af52210b8f9b4529b470ba1eaa09 authored over 3 years ago
3030a018e5512502f1da99992e6520200992082f authored over 3 years ago
Improve docs
80e3fde84cbb931631d1d5a4e5f7ab0a481107ef authored over 3 years ago545b3633b72c8a1186191d4949e44073fcccd39d authored over 3 years ago
ce10a4710da275308f5ab80d047a8db29517669a authored over 3 years ago
07e3dc34d79817f7abbf77ee1192a3d7e32c1bd5 authored over 3 years ago
2438d48ebd56bbf1d4974a59c2f30cf4a9fa40d2 authored over 3 years ago
076cf6e4b5546b5e1a44b0b96ec59f53b1707173 authored over 3 years ago
654a8232172e673a51624adf505c569b47ce71c5 authored over 3 years ago