poraque_active_learning.py,sha256=-cPLcLvm79CJnH_CZuB7xJcWwTil0tXZsFsTnDteIUw,14930
poraque_atoms.py,sha256=-9Ey2D9D3jWyXeIS27p_4LAdhdHjh2WUzGiIGhgKqQY,8949
poraque_committee.py,sha256=pr5dDmv24dcFpjvOWD44o1vhWp_dnZ9p9M30RvMoPnc,19295
poraque_inference.py,sha256=jaFLhQV_zglD1PWKIVIN21Hv_hPL4iOL1JZ5OH_KgNc,66866
poraque_train.py,sha256=UeWvOEIwGGCCqKvlyMblyaSSF3HpVCERh24vstsYVqc,175237
poraque_vasp.py,sha256=5HDEx4vlxEb5kJCB1m3NJQzJyWFvXXYe46u8lU3SOuI,25121
poraque/__init__.py,sha256=8T1yBT_HJKLOoj2zBUeXAUdggEsc2py4016UnaT4F_o,2014
poraque/calculator.py,sha256=pQsIy0zURm7h-97zxhpv-lj8nXoqONh4kCZG6jmaows,49236
poraque/environment.py,sha256=h2HuY5hQFaOd8kXd0BrZR0ikCmAABgQA6TsPCAT31uk,6574
poraque/version.py,sha256=mlRRlO4KFObkc0Y2DajbQGtQl4ZY6PsNQGxPRI-XRPU,190
poraque/analysis/__init__.py,sha256=TYfrIQIN9RzCBcd_chIVOGUP8ijkqPXcAKVrPF9gveU,1168
poraque/analysis/charges.py,sha256=3Ctcaan3y5CcPMK3QcItVBQfQ45mVvlS6t_ySbKaBjc,37528
poraque/data/__init__.py,sha256=UqZXrkZVFoY9Tewwrd7r2akbV0jLr-faaIZ_PnlsYc4,2222
poraque/data/cache.py,sha256=ENI8I3CQEx7TINbIa7hkkFFCbRoKAEaRt52nZoQ2I1w,48320
poraque/data/dataset.py,sha256=KPHtOR6lvFDRB7B1tYSReDd65_unaYW2lLzctqXzj8k,17724
poraque/data/materials_project.py,sha256=5DxqMIvWyNwr-cWHl_p1KpmaN14_ifzZxeEr2u3_tVk,118107
poraque/data/mp_dataset.py,sha256=cfQDTehBeFJwX87iFJQj4eiqAg5oI99FG-nDG8p0X0k,11753
poraque/data/provenance.py,sha256=0QlavSzzj4XL_JYD9vUBsSAxO1cg4Lx2GR7OT7cwjG8,3194
poraque/data/sources.py,sha256=r03XpsjX9dzGvlnLCiEZrAeDUyt_u8KTbQ6v4AdcqRk,49089
poraque/fields/__init__.py,sha256=GGU6f_ZNY8gCFpv_4icMHgSennsgiRSikBF4ALMj7XA,2840
poraque/fields/atomic.py,sha256=TIija-yIa0pcTnT9lWDyfUa0ZOIwsQ9M9HfqldQG_30,42849
poraque/fields/base.py,sha256=o0Cy5DDFuMQ4nsm0cO0d99LIsDgdNDgiEmcbIwOnn7w,24301
poraque/fields/constants.py,sha256=TZib2m_LrEkJ1cJrHZfWaHWGQ-5cAOSDrxftM2OeLHU,1490
poraque/fields/density.py,sha256=Q3ngxTbutpaFS_UX9oWYHmcfLu5UuB7M5wUygJsHUpY,11485
poraque/fields/external.py,sha256=G8_oKGXKLmjFUV47ZlGkmR35RR1-wndwNVxQ-WmhL0g,29896
poraque/fields/grid.py,sha256=IoqGZ7tHmOdENJ7kp1RvCj95acKxgjBkbzktCsUefwI,16184
poraque/fields/hartree.py,sha256=0xsNpugt2xzG4wxSFwyY0HULOBmNH4arBVJvwZFMi90,5750
poraque/fields/hdf5.py,sha256=Jv3dYth1c2K8HliQvYaSgFXTHZh6L2DDwyqet8KPBp4,33812
poraque/fields/resample.py,sha256=uf3qpByL2DjxikcnoX41qjJOOV2NNAcMPZHUYlmxezE,9077
poraque/fields/spin.py,sha256=6kdFvCNLGe9kvfdnvjYjieL6UHfrbszOjeBDKQJk7DQ,16804
poraque/fields/structure.py,sha256=v3eaZqFu6iTe10oPhjKddUci2ipCPWD16DvWublY7XQ,7689
poraque/fields/io/__init__.py,sha256=pG08TvYBpsJgJ5vf_1CEVRUSnKNl7W5ojCrwwI4y3Ds,8615
poraque/fields/io/aims.py,sha256=s2cJrGcUgDCfkCF12KQs-NGSqAbnPOEguIWvTz9y_RM,11922
poraque/fields/io/base.py,sha256=dzmyLLG6J4afE_pdxk4Rk_7-LdrZENaqtQzByE-oKUg,9912
poraque/fields/io/compressed.py,sha256=X-JgImjv7K4Y-J2GGSXR-3FnNcUkCZkKNInAJYPXi1I,5768
poraque/fields/io/espresso.py,sha256=Sw4xvF-JKwHCFqzZb--N9V819oC1_JhlqSDlm0rZwQQ,6497
poraque/fields/io/gpaw.py,sha256=G9bmEqBvp4NG6UdDHh6J3VhFmbyREL7aI-yV1YHswgc,5912
poraque/fields/io/vasp.py,sha256=WCD-84GibAMwLkrRusQ8O18OFEMAGScL_HdH2L-7U3o,5077
poraque/fields/vasp/__init__.py,sha256=1fy0hNuVQxX-quOJxM9hEcWNkOeqbKgoaVP-3Hmjy5M,1433
poraque/fields/vasp/augmentation.py,sha256=YEMIMSQLJHvIyb2vLoSJXwAPs35pCbJoAlN0F15cVEA,17872
poraque/fields/vasp/fftgrid.py,sha256=KH50rXwd51cs9t-gRAO4__v7lQkg25HwGDR31Znlk6E,5287
poraque/fields/vasp/incar.py,sha256=eq7h_5usAjc6nbwitGk79ddQ0PQhIWL2dUlh-m1-QGM,3639
poraque/fields/vasp/paw_setup.py,sha256=EaaqsJwUSi-gyy5G1omvKZerei63Jdc_mQNrYBDOB7c,10879
poraque/fields/vasp/poscar.py,sha256=JUYuHkeP_muQQa6458aUqtEDgaLPR4EHv7GIo61xvLA,6500
poraque/fields/vasp/potcar.py,sha256=VgPumUF8tYR4eA5wJN7MnhSRgZzaw1_yiRKl4J4FbHA,26489
poraque/fields/vasp/templates.py,sha256=A0ul9NaGxetT_odAIpBpJ84PmDlb4XdZO3-PfaF6jfk,33987
poraque/fields/vasp/volumetric.py,sha256=UTACE71BTQunkbkYtjO60SNaQvKzFhQsD63ozyXKQ8Y,18804
poraque/ml/__init__.py,sha256=XgTxu6B-5JCfouDdTQ3pwQvXayw_CBCkkClwkajPDG0,7632
poraque/ml/active_learning.py,sha256=sY4rUCPuZ-Qc_RWJZOwM8TdQ30mpf9lHJrcP5sTn7o8,26143
poraque/ml/backend.py,sha256=O0UViQXy7NjUJqP4Bnz6XwCdLJGbxMOBSJTgskNfq5s,21052
poraque/ml/committee.py,sha256=diuImeiP0R_uK720l_x7s6eu0mb4zUfwR8LlpR2TvTE,23374
poraque/ml/config.py,sha256=x2QlqydKquyBSTc2Uj1ud7VYthS46milkAw2x24KdjQ,144520
poraque/ml/data.py,sha256=L2jYyDy6mEfnxQUa1UDACGbhmsr7n2W_wgKEheYTtfE,61706
poraque/ml/device.py,sha256=6OhAEoNeZ3NIkLk483CscCVvOTrcEZW1QfdJQtVsWTc,23510
poraque/ml/distributed.py,sha256=i43xJO_LoANNL04xbZ6I3Cm_Gu4bYleJhPxxNV2XqZE,24880
poraque/ml/energy.py,sha256=Ibv21fuVmW5Tdi5Fjqb-nEMZwnpQcV2Kn_XFQQ2P_F8,28348
poraque/ml/fno.py,sha256=DXz76-2En9n-VZbHy5Om4xagvTDjNa7urWSX1fCwiKo,74301
poraque/ml/gp.py,sha256=6CQahaBljSBV4nWPnnaJ2IdA6sMwICbeSF_-gvYn3qk,35340
poraque/ml/heads.py,sha256=X1jE2fdEdVLGqIBzEVrWwM7lPlfofoWo0ZAMpeJJXhU,10583
poraque/ml/kan.py,sha256=Fg5GrjCWHBX-zgpH25fAORyX4ScNQc5L7hqox4QrYQc,44034
poraque/ml/lora.py,sha256=xoKb7bnirkGkCV6ne31-uPP-5TCcWPSUjUS07ANawxU,10727
poraque/ml/losses.py,sha256=yCF3LX_fVYTTEABaHUT7khplRcwrX5oLoEcPF57vMX0,22989
poraque/ml/paw.py,sha256=HJP84hcLta8LgrvoN2CTQkQYeRsvBWu5DpR1mvqQ8PE,50992
poraque/ml/physics.py,sha256=l19KKi1NT_Gjs1HBjrvYFkGfmtsuBex4pSr2JLntbac,47292
poraque/ml/profiling.py,sha256=HSzYwcNuTPaAoHlacEQIlrcoRqHzPvIElSl5eYzPM-g,10914
poraque/ml/symbolic.py,sha256=RrE-BS_GX1MXI9TEOD33SH1isQS88tyvCoYl03oCfBw,71460
poraque/ml/tasks.py,sha256=oVt412w214hA8qXWEgB4lVY239jcLdFEoKYx4bJ98Ys,6431
poraque/ml/training.py,sha256=hnT7N14HpU9Qq9h913KcAXUrz2s0w8GExVEuVCSVT-k,100682
poraque/ml/transforms.py,sha256=EilKKWsDHL9lx8ptpKpq23_ucIbSRT6rW12f4UPpsTA,8580
poraque/physics/__init__.py,sha256=k_frr2JrN6kr7NrHIYp-yNMM2wUqE7ZzQWWTQ1jR0Xk,1875
poraque/physics/energy.py,sha256=gSSXECslvKfTh-QO1z47gRwH5e9DRE3dGC3gvN8FbpA,44575
poraque/physics/forces.py,sha256=Zu3RhygmhrZvAKyFHxs9tFfxsmNkDjh8zPtTyiQGJxs,11857
poraque/physics/paw.py,sha256=B2PYl5Og7NQ5-1v0jmku2rH9AJuksUzYoYfo4ObEBUk,32719
poraque/physics/reference.py,sha256=6NwmfgsFxVfBlqGzOQ891rV4p95e4bLepK5guFMVxmM,17740
poraque/physics/xc.py,sha256=o76AvRa7jkuwti0Q8iY9FVq09duLRRvLBJM4OFznrIE,8225
poraque/utils/__init__.py,sha256=z22Q3fIVVjs3X1CLYe3BFioVBewtnsc3AkAOfru_TNU,357
poraque/utils/logging.py,sha256=K9VH3ervVx7bOxtEsTteKnS71fppS-779_r0D4h0kQ8,9700
poraque/vis/__init__.py,sha256=o2fs7RthmW2Mu5NCZBnJzi1tXHJSsiicJ8nPov7ZQcg,2250
poraque/vis/parity.py,sha256=R9MSQdnP5MXrLMUHsBJvf8GmUqXuJcytDCLwhxkPpwM,8385
poraque/vis/pdf_report.py,sha256=1FjLYgXttnl_KySE9OMqId_VbZH3OelwyQE0cN94vBU,47604
poraque/vis/report.py,sha256=gEjrQDr5jsXxJQqdFuNpBA8MYAM1wRQMGDaidK3vP5A,46272
poraque/vis/style.py,sha256=ClbUFSipjZO8DXE4_ndrm5sHHUxfMwgLmyPfMILl5HE,5727
poraque/ml/_spectral.c,sha256=r6ifmE_kV8cmG60FaI2zVK9-S5ZAA7d32B6x8pczogI,14046
poraque-26.10.4.dist-info/METADATA,sha256=KlQ3H3t9hLZ-CbkCMQsZ_uPIXYLuIoqApPHimJBqc6M,29413
poraque-26.10.4.dist-info/WHEEL,sha256=W3fkpkm7-wf9vBI5Z-7s0eWkeM-spu78I8Neb98DeEg,87
poraque-26.10.4.dist-info/entry_points.txt,sha256=Ij9A5w8KNmfZO0uF4sctJNcknIqZVMCuSPEwoWhj5Gg,311
poraque-26.10.4.dist-info/licenses/LICENSE,sha256=KlL-BmXdbRLsfD5Eoe_RvO2wZtrLPQC7FtS5TtJXMTs,1077
poraque-26.10.4.dist-info/RECORD,,
