poraque_active_learning.py,sha256=6Cyxsh0r-KAyr8R8_XZ2o98FrKg-Dt1Ma_8AoJBnaWw,13154
poraque_atoms.py,sha256=QkVTHb19nZtAUoBUmJAS3WPAGPj1YVOudkAkZIwyNE4,7896
poraque_committee.py,sha256=kHmaz9Ti4KGyNKn4OiAaVcvuuRmOlwLlobW9y2kZA2U,17490
poraque_inference.py,sha256=Ep89V4QCzsOz7SLrPEAF3wLcMVdfnXC4n-77YMlnUE4,52219
poraque_train.py,sha256=l-q6GAVczhgkMCOsA9JR8-fGFA4YgqEH0teUmTx0V8A,151130
poraque_vasp.py,sha256=cCbIZYm0r10CFxvsIMC49L1ncuFzyDwztmgHMVEboFw,23910
poraque/__init__.py,sha256=8T1yBT_HJKLOoj2zBUeXAUdggEsc2py4016UnaT4F_o,2014
poraque/calculator.py,sha256=1r-cwyszXcgqhUu9gyJ8-67HXd-OFX0UeZW23XXFwnA,42438
poraque/environment.py,sha256=WT5_zIddFcAN-390Qcat37HhTXyvnqDknO7gbAcVego,7021
poraque/version.py,sha256=0VIdavKh47uUkGSlgXlm6UWTMsa8zur1mlx_9lMCzMc,190
poraque/analysis/__init__.py,sha256=TYfrIQIN9RzCBcd_chIVOGUP8ijkqPXcAKVrPF9gveU,1168
poraque/analysis/charges.py,sha256=q2aDSPiA3Szhva4eyO_c5PndwamI6UfH98hMv89XMOc,37538
poraque/data/__init__.py,sha256=Dnu9B9gMN7vnHjuM9dAC303G6uJ5B_TjfGG2TzSBXwg,2222
poraque/data/cache.py,sha256=0l1SdOk_Z90bjfSJsq1tVsbVE-nFuFkhiy_f-Fe3eWw,45515
poraque/data/dataset.py,sha256=IDFc3ZT6FGpPIsMwMXQ7i-8soJP5YMUf6ShaPPELaK0,17524
poraque/data/materials_project.py,sha256=QY0BqyCS2Xy78EZTM7ZzMa1ReXXbVPHuPtYPiajmfew,114982
poraque/data/mp_dataset.py,sha256=w_y_BxJ-u6mlF2RCmfEIh3WkFoXfKIsRUvRboxxXPXM,11753
poraque/data/provenance.py,sha256=0QlavSzzj4XL_JYD9vUBsSAxO1cg4Lx2GR7OT7cwjG8,3194
poraque/data/sources.py,sha256=sq4oMOvSXdClBzqoG2gWU-FbV5wvlv-pJKQjdu8OMKQ,49093
poraque/fields/__init__.py,sha256=JnQyquEJpxOo3KIKmvZqzplz6qc5ahbTHwekYiDBxVs,2840
poraque/fields/atomic.py,sha256=W8k-MmJevPyNRN62nqR44hPc7G2YDzMrZqdHACwvF_I,36698
poraque/fields/base.py,sha256=zZy1dPevxqRUeRHaSr4bN4khnxD7v93_RliIk5JVrPM,24301
poraque/fields/constants.py,sha256=TZib2m_LrEkJ1cJrHZfWaHWGQ-5cAOSDrxftM2OeLHU,1490
poraque/fields/density.py,sha256=kobNwIHm2WrWViRBb2-Oz1jq8LX-FWqwXuANE-TEHY0,11487
poraque/fields/external.py,sha256=YYcPmNhUjMTWM3ywoEfoV231lTnD24QDC-tSlv5G5cQ,29186
poraque/fields/grid.py,sha256=VYBNlvUXwPS2aIQH9DTECvyQi2pPovZIFh9nNdJH9UA,16185
poraque/fields/hartree.py,sha256=McjYP0edThCJ46rh13MiWV_eMntgxHbGoh_HgPI4uyQ,5750
poraque/fields/hdf5.py,sha256=u4W5hQdwiO1Yg_vNZ3OscE1Sv0rQN946QnDfhozbUZQ,33813
poraque/fields/resample.py,sha256=ACv8-1cnZmdtcTRBbsFEuuE-FMJz8kJxps3dhKyDl0Y,7882
poraque/fields/spin.py,sha256=VnRmwwmEZw8xLvBJzzFjgyewrw0Lo4xpoWz-L4O08N0,16805
poraque/fields/structure.py,sha256=v3eaZqFu6iTe10oPhjKddUci2ipCPWD16DvWublY7XQ,7689
poraque/fields/io/__init__.py,sha256=PgHhKAFEl1SbB_xvEhRxYrtLpuLgMcHiCFULiv_Sp3E,8616
poraque/fields/io/aims.py,sha256=thdaKSWiutpbEzCqgAm2He3BPXNWzjblPrWDLmDUnB4,11921
poraque/fields/io/base.py,sha256=dzmyLLG6J4afE_pdxk4Rk_7-LdrZENaqtQzByE-oKUg,9912
poraque/fields/io/compressed.py,sha256=IhaLc_b08ecvoYkB0KkOKi2lmwMiNJTXvPosFYE7hnk,5768
poraque/fields/io/espresso.py,sha256=cD5shT7TNgTRO7rA-bHK8IbV1n0mBuxdwVAy26RFpEY,6499
poraque/fields/io/gpaw.py,sha256=BD1i2q7BZ1ZleLw29SBYU1sXrHMj-maeV7E9UU9TCFc,5918
poraque/fields/io/vasp.py,sha256=ELCEotkD1OQDojoLsanfFMPfzO_trww69qFC1vs2p0I,5078
poraque/fields/vasp/__init__.py,sha256=1fy0hNuVQxX-quOJxM9hEcWNkOeqbKgoaVP-3Hmjy5M,1433
poraque/fields/vasp/augmentation.py,sha256=bcmFBmVyVNoww7r5ONUqD9RGelui7NpBiYFJZiqlypc,9498
poraque/fields/vasp/fftgrid.py,sha256=KH50rXwd51cs9t-gRAO4__v7lQkg25HwGDR31Znlk6E,5287
poraque/fields/vasp/incar.py,sha256=eq7h_5usAjc6nbwitGk79ddQ0PQhIWL2dUlh-m1-QGM,3639
poraque/fields/vasp/poscar.py,sha256=JUYuHkeP_muQQa6458aUqtEDgaLPR4EHv7GIo61xvLA,6500
poraque/fields/vasp/potcar.py,sha256=MK8-mIx0MUPuPyLwqL4-VvuSnPQd6M_v1i8p1cKd-Mw,24455
poraque/fields/vasp/templates.py,sha256=tDVmCKpjaom89H5N_xRv1fNqjV3TbT99APIzyuDlxLg,33982
poraque/fields/vasp/volumetric.py,sha256=5qL5gOEGN5E0TVjd396BYen0EF6GujX9zr6_9tDRugE,18804
poraque/ml/__init__.py,sha256=ioNAx4iLmm6u_5LyefsWfaMoXeQZKTQfHTV_AjddGrA,7561
poraque/ml/active_learning.py,sha256=DZqq04jK6IT0jg2mK44MTQsj0skZL2FVu7thN1s6s9w,26152
poraque/ml/backend.py,sha256=lsiRwYqcfZKQgFN_NVqbqtb--A74H5rndqTQGymmztk,20942
poraque/ml/committee.py,sha256=wq72QBH9OKWOzHjrR1U_vjVbSgMQXIiXFhiKPMzcwJg,23377
poraque/ml/config.py,sha256=rOSxJR3dKHekm2ANsr9UkXOnQ-P6fUwMSrWjFfQcqy4,129622
poraque/ml/data.py,sha256=b_fpNPNmWxnVIexIhZF7nEvH3LiXpqSBM2faoEHq7us,47283
poraque/ml/device.py,sha256=KSh_E_5pKrmiCKzAisWxy3XuY_RoZ_QTTWjKM82_d3Q,23511
poraque/ml/distributed.py,sha256=7s_ZkBbtwEJOd8S_fejr78QpTECMAPPxDtsyr0R1ZRA,24880
poraque/ml/fno.py,sha256=oRaQoyTTlMFF2BfM36jHiEIkkfBcpulZPxgMcolcCyM,73562
poraque/ml/gp.py,sha256=E5FHSf2_QNggMpnfZQdB0PJ6vpGaZ9b-2A4vrxaRnas,35340
poraque/ml/heads.py,sha256=vjNT7pcORA8EP_JyAuodud_KwGQ4JUD-_1As7DtWv_E,10583
poraque/ml/kan.py,sha256=ZChIWdIgC6oACbplI7E_4Kwsn8jOs6XnlPZcqMvcm-0,44036
poraque/ml/lora.py,sha256=sJCXJvJWYOb2RnufIJpuMMOyZARdupG7YmK3AduREg0,10727
poraque/ml/losses.py,sha256=P4z8ogQUGj45c9QEKPzY5Cli4ERPf7ywULijeKsQWOo,22550
poraque/ml/physics.py,sha256=8QMNksxVrKlwo0zp4881VBSLe1LNSLZy_-3Y68FlQGU,47292
poraque/ml/symbolic.py,sha256=6VjA-VMEtQxRANaEt06dJHdwTQR-HnIfmiOjStMKp4g,71463
poraque/ml/tasks.py,sha256=lYD9ycldy9Dy8Qui5i5_Q6PO9AARwzzfGsBDlAv2eec,3235
poraque/ml/training.py,sha256=-iCwALuxLiGzfOHHScwxD3wM7JxlYIivUYLoSbku_iw,71612
poraque/ml/transforms.py,sha256=qsSQ4ry_qcIujZ8haVzzy6VssE1rsi8iuDyi5-3tkcs,8580
poraque/physics/__init__.py,sha256=k_frr2JrN6kr7NrHIYp-yNMM2wUqE7ZzQWWTQ1jR0Xk,1875
poraque/physics/energy.py,sha256=ShXOqYc2ArwVJl6JNR84PiheR8BDCUIr4PApWIFaxDM,44575
poraque/physics/forces.py,sha256=pISX9i39WvSfXjUs8wcCAm2azPwXDFLHXa7M8AHT-dI,11857
poraque/physics/reference.py,sha256=Fy9g4XRrq8MkRmBs2hvkQ-TXiQlijdlMDgpSyXrNgEg,17740
poraque/vis/__init__.py,sha256=nStJugARGAYUw54pwQ-NGZLwe_Qm-2z29hsBcajavwY,2204
poraque/vis/pdf_report.py,sha256=9NdyX3edUwHdtxVDE0-at5D4GHr60HuAe2U3zXvzNrA,47170
poraque/vis/report.py,sha256=Vj-K9glsEPqmV7EFiP7ZllGSvtByBv_EHhMeF6aYrog,41326
poraque/vis/style.py,sha256=zw5XHbl5tIRSc_A3RpmYAgHOsTW4-lKmEHFE2_sBGow,5735
poraque/ml/_spectral.c,sha256=q4SHQUnQ2X3rp8DsqLxyqnURQPgesPh2JWEXvub9gjc,14046
poraque-26.9.12.dist-info/METADATA,sha256=5ogSaWd3sK4uc9qLxJgpMIYEPLZQdRgCaln0P4KOnAE,29712
poraque-26.9.12.dist-info/WHEEL,sha256=zOwg4jB6zX2kU910N-cMawjivD6tO8NEWvE12je1bVk,87
poraque-26.9.12.dist-info/entry_points.txt,sha256=Ij9A5w8KNmfZO0uF4sctJNcknIqZVMCuSPEwoWhj5Gg,311
poraque-26.9.12.dist-info/licenses/LICENSE,sha256=KlL-BmXdbRLsfD5Eoe_RvO2wZtrLPQC7FtS5TtJXMTs,1077
poraque-26.9.12.dist-info/RECORD,,
