Path |
Digest |
Size |
jarvis/__init__.py |
sha256=AneiZWuJN5wamS7hXIVIT17PRQ7F1LVmLxHbgDF9Ap4
|
246 |
jarvis/ai/__init__.py |
sha256=ikH__sCdu5FV5LSQJZY-XhGo9gRmhEqQKZgCsFlFuUY
|
35 |
jarvis/ai/descriptors/__init__.py |
sha256=6LC5tJNASTw2fOZBtYjfBgtODYWRerQR1qySqGvfaNE
|
48 |
jarvis/ai/descriptors/cfid.py |
sha256=Pn0R1uXDXNNDdsaUJCnSg8Ue-P4O-ONGthPkd5RqzeQ
|
48400 |
jarvis/ai/descriptors/coulomb.py |
sha256=KjatR_5gGeL4fSA18jYdIxo0TGKwXgToGbpbEM3MWjQ
|
1370 |
jarvis/ai/descriptors/elemental.py |
sha256=gUcD8MJ7KZLk35qozpSp1HXHeYTa1CLhwb7v1HXLAcg
|
511 |
jarvis/ai/gcn/__init__.py |
sha256=6Ne8O609Xri805LmheznhCfUZjE-wfYqm3MxmP0rqNI
|
47 |
jarvis/ai/pkgs/__init__.py |
sha256=quDXsL9IBxCfIJrCuRidVGBKxWiKG6JXlUl5Ol_W6mg
|
35 |
jarvis/ai/pkgs/utils.py |
sha256=yyIF392vb9T0Cfvd3s_ZlIS9VqY1bVSn3e6DdXNTgBI
|
3585 |
jarvis/ai/pkgs/lgbm/__init__.py |
sha256=I7kbFZeuO5hvEOpy5hgBSYgXfckwv4dewC585xb4QBE
|
28 |
jarvis/ai/pkgs/lgbm/classification.py |
sha256=ron_FVinI_nl_RFr9usKjcJ7fyB746Iflh8ZS_RMu0o
|
1148 |
jarvis/ai/pkgs/lgbm/regression.py |
sha256=MGzNvA7WntC-CmVvsnSqJ2iE-wTX85ZNUCo2N20QC04
|
9541 |
jarvis/ai/pkgs/sklearn/__init__.py |
sha256=e7kOguTJiy3V60X76XuZC4C-B4vyj6rg2Ofzw4CY_CA
|
44 |
jarvis/ai/pkgs/sklearn/classification.py |
sha256=VdMpQqlLkmxlLCiwjIrxQaJcnnv7aKDnRoWymg6Afyk
|
5144 |
jarvis/ai/pkgs/sklearn/hyper_params.py |
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|
11368 |
jarvis/ai/pkgs/sklearn/regression.py |
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|
2969 |
jarvis/ai/uncertainty/__init__.py |
sha256=wbNvSBYZABZ7nTv8Cho7URfX6oDg7HiNCKbkQjJ2Pgo
|
34 |
jarvis/ai/uncertainty/gaussian_process_uncertainty.py |
sha256=FvW68VbFZ_hputNSdaVh3dHNMif4s7g1-xSIplV3MS8
|
5573 |
jarvis/ai/uncertainty/lgbm_quantile_uncertainty.py |
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|
7534 |
jarvis/analysis/__init__.py |
sha256=Kv3PxY222-dMYARX405mvHKvpLMVjUXn5n4Iabn9TO0
|
35 |
jarvis/analysis/darkmatter/__init__.py |
sha256=tob9z4uRl0T38fYM_ON9aF8NWxHuekbz3IFXZ0vK8TM
|
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jarvis/analysis/darkmatter/metrics.py |
sha256=246Ku4uyFQD89ppHcWBKhHdPT1RlBy2lVFpmPgzu9KI
|
786 |
jarvis/analysis/defects/__init__.py |
sha256=xBfzvFArcI79n7Wnb_16iFlpptc-ymKI_nH9ILdqJsM
|
47 |
jarvis/analysis/defects/substitutions.py |
sha256=q3yvHPKOzJ3oJ5tZDzaWz6XQDCT1xQxRrmsgAy1kH1w
|
2328 |
jarvis/analysis/defects/surface.py |
sha256=zuCzO9pNVcUdMygIPcc-Fz9CY7YjHe8hcNxf4lM1_Kg
|
10071 |
jarvis/analysis/defects/vacancy.py |
sha256=RguOz726DtnIzkGkmtWcyan_qOjxEQlSbJReLi53fS8
|
5048 |
jarvis/analysis/diffraction/__init__.py |
sha256=Jo7RV-BaBb6Pxj62E0rlSPcgS1rqa7zrdoadRbckWzw
|
49 |
jarvis/analysis/diffraction/atomic_scattering_params.json |
sha256=xnUwEki7huo1lCjyDDmH1xmxrBp3kWbvJ-HQ9lJGfZM
|
6825 |
jarvis/analysis/diffraction/xrd.py |
sha256=SGiX-WtdbTQCi2UYr-2GYblkXYzpt6abZHUcBi3eic0
|
7327 |
jarvis/analysis/elastic/__init__.py |
sha256=gjCk4xSTRONe4g5CLk6Io5wXeMs8eL8bMYvJ9TiwrKQ
|
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jarvis/analysis/elastic/tensor.py |
sha256=silSwv8cROgmhmJeZBctR34K9-_stYwhAJX6xWacwFk
|
6602 |
jarvis/analysis/interface/__init__.py |
sha256=4RHPBnnV2678eiFc3cH6jOOOuXhpiCwDzOY0HpclnXg
|
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jarvis/analysis/interface/zur.py |
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|
14764 |
jarvis/analysis/magnetism/__init__.py |
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|
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jarvis/analysis/magnetism/magmom_setup.py |
sha256=imrdY3RIJ3mJc85444FYV9DxArEeOHgXjeSYSPvQZHw
|
8101 |
jarvis/analysis/periodic/__init__.py |
sha256=kpEkOLvCndxWvNM7gNQ-sOzwTcSewPbqFWqYyTKtBB0
|
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jarvis/analysis/periodic/ptable.py |
sha256=psinOKvUkJEC7EuDy6mWjYj0gXTCSxPpcAUhtHPGL78
|
5907 |
jarvis/analysis/phonon/__init__.py |
sha256=QkcIWa97WbtXS-EO0z8LgVLjKK_h5kvEhLuam_kHARk
|
49 |
jarvis/analysis/phonon/dos.py |
sha256=GfRQ7TxzHYo9hNCtZz_O1CZJKlWC2DDWTaMuxtyeox0
|
3934 |
jarvis/analysis/phonon/force_constants.py |
sha256=FiNbqIROck_Jr4BZCHuDMOP8W3T0GKWXU91Z4BrOm9c
|
1189 |
jarvis/analysis/phonon/ir.py |
sha256=RU3vF8OX-ng6GMrOhYKm_dtGkK58Q0spxsCWxMKZT3g
|
6473 |
jarvis/analysis/solarefficiency/__init__.py |
sha256=pRk_3SSBCZjZhwE03K9WjeAS3hk1aEl4vn4GKgQFiuE
|
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jarvis/analysis/solarefficiency/am1.5G.dat |
sha256=mVckWWw9dAOq72WtuK6yOJtaBcXWGwiSE7DuhXasuNY
|
35436 |
jarvis/analysis/solarefficiency/solar.py |
sha256=r8R3n-SKHLzVTaw1JDrmPgmg0k0ayM2HJAqV9hvbbQE
|
14291 |
jarvis/analysis/stem/__init__.py |
sha256=oLtnl6tsDlLh_HHI0kxTSEKDL_e8IkmgETWiUMmB3Ko
|
38 |
jarvis/analysis/stem/convolution_apprx.py |
sha256=USA5UnLfDLkxGm_xLrUqDanbZenYIl8kJYnTIjxIw-c
|
7315 |
jarvis/analysis/stm/__init__.py |
sha256=t3ElfSbGySR-E2ezplpZJZ7smRjiureiv4tJRI8Qg_I
|
67 |
jarvis/analysis/stm/tersoff_hamann.py |
sha256=7bYO0KImfVr5M5T1yZkTfwxVSNu0THwrb085ALrsa5c
|
10094 |
jarvis/analysis/structure/__init__.py |
sha256=PabZBF134GBbPyetHk6iiApaEQsQs8uamByVk45F4Ho
|
46 |
jarvis/analysis/structure/neighbors.py |
sha256=4VYpJUsjcf0RzK-OkyihhS-aoD4i2xVhB3i9egE6m8w
|
21798 |
jarvis/analysis/structure/spacegroup.py |
sha256=mPcHK7gbt_5-CRzOSw_PHYO-IDmovuynlSVZuyziW7E
|
25716 |
jarvis/analysis/thermodynamics/__init__.py |
sha256=0aty0mMi__Fk-HGOBZdDARfI7p-8YLHlw_NYXJDDlAM
|
42 |
jarvis/analysis/thermodynamics/energetics.py |
sha256=Lqx1F74rJ4huuNGtaOUPg3vPu1FMS6dSmJAnt4PH5kA
|
14613 |
jarvis/analysis/thermodynamics/unary.json |
sha256=wQcs5VKXqBR3To0VHPUWCzjriPE5ML4pkX0ulfHsxYM
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4527 |
jarvis/analysis/thermodynamics/unary_qe_tb.json |
sha256=37lE6knXAzHaNfbmdLhQUH-OivlROz3iYEyosMFt33U
|
4781 |
jarvis/analysis/topological/__init__.py |
sha256=2nXhtsmUYH5kJBMAx8Tj9-7Zi-lIIce-Jie6l0Rsctg
|
50 |
jarvis/analysis/topological/spillage.py |
sha256=mJ32lWu-_64f_lmkCwvuh5m0KpiM2vyE3b0twX4Ct8g
|
11892 |
jarvis/core/Elements.json |
sha256=4-F1F-vLt7_jxIbRPWoTqufhG3FlzGAO5rueve9uSvA
|
1421253 |
jarvis/core/__init__.py |
sha256=f5MiduWMthIliJ0J3klSrUtYQymaClMbOdz0ux5UsGU
|
49 |
jarvis/core/atom_init.json |
sha256=qrmzDzAOG4cbVg7ypxXENWiANJKTsiK0oUYI_4csgP4
|
28393 |
jarvis/core/atoms.py |
sha256=VyrAk9t-LJo9kgoN9znM2oSfHEFbqch4UU56MfUC1B4
|
86188 |
jarvis/core/circuits.py |
sha256=XhlCi3iaUJsCI2CM3Xbz58uCc8C87gQDlCA-4YOb_0c
|
4313 |
jarvis/core/composition.py |
sha256=2-X8gvl7ss3ZeuGi1wOE8wBvdxep_LJ6Bn2M0eXa8bE
|
6320 |
jarvis/core/element_charge.json |
sha256=ME3izHCnnKdi9v5VeL5HnujHj362tHeWx-orvfubPK4
|
1162701 |
jarvis/core/element_names.json |
sha256=tXZQVzxxg01EDFHVG85KR2-dibghAtE_Ti7Y0d-GosQ
|
2562 |
jarvis/core/graphs.py |
sha256=K04AJuBOH2yI4RpxbB7PutW7pLGZxvW4l3EAeYDO458
|
22713 |
jarvis/core/image.py |
sha256=tIJFqywD8nmPd8-dX-kf_2phBLfk-QiqEixL_NBoJC8
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10693 |
jarvis/core/kpoints.py |
sha256=CZspQzpSTKxK2n7i2PSull-04ZNaBSFhNsRMY9p78JY
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37783 |
jarvis/core/lattice.py |
sha256=3vbIgBX5JpPZMUlD-RvWUPjZjhbbtfefLiAKkya6ZLk
|
17722 |
jarvis/core/magpie.json |
sha256=-AIhwq-fQQBtsZWkA80aU215rIKXANQf9QySHlMoncw
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47766 |
jarvis/core/mineral_name_prototype.json.zip |
sha256=w-LT7zZvEomXbn-2hFpoM9Iyssst8Kq2jzwjSRdTCX8
|
3215996 |
jarvis/core/specie.py |
sha256=9IZ1fhsoJnwVl_Vw9M0tkcucV2oSwGVxwuSWatMdUM0
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12281 |
jarvis/core/spectrum.py |
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2891 |
jarvis/core/utils.py |
sha256=CwqrVSwGjzgF7NruU5l_lyHJ2nLvGskfyjGRg-nsjeI
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10172 |
jarvis/db/__init__.py |
sha256=fd9rXgzZBTJ_oK-Ih3Jyt4JAYUsruLpnVdfdIgxuqns
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jarvis/db/figshare.py |
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30306 |
jarvis/db/jsonutils.py |
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jarvis/db/lammps_to_xml.py |
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7761 |
jarvis/db/qe_to_xml.py |
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10649 |
jarvis/db/restapi.py |
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17359 |
jarvis/db/vasp_to_xml.py |
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75218 |
jarvis/db/webpages.py |
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9586 |
jarvis/io/__init__.py |
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jarvis/io/boltztrap/__init__.py |
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jarvis/io/boltztrap/inputs.py |
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jarvis/io/boltztrap/outputs.py |
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jarvis/io/calphad/__init__.py |
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jarvis/io/calphad/write_decorated_poscar.py |
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4228 |
jarvis/io/lammps/__init__.py |
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jarvis/io/lammps/inputs.py |
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jarvis/io/lammps/outputs.py |
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jarvis/io/nexus/__init__.py |
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jarvis/io/nexus/inputs.py |
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jarvis/io/nexus/outputs.py |
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jarvis/io/pennylane/__init__.py |
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jarvis/io/pennylane/inputs.py |
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jarvis/io/phonopy/__init__.py |
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jarvis/io/phonopy/fcmat2hr.py |
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jarvis/io/phonopy/inputs.py |
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jarvis/io/phonopy/outputs.py |
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jarvis/io/prismatic/__init__.py |
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jarvis/io/prismatic/inputs.py |
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jarvis/io/qe/__init__.py |
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jarvis/io/qe/inputs.py |
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jarvis/io/qe/outputs.py |
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jarvis/io/qiskit/__init__.py |
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jarvis/io/qiskit/inputs.py |
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jarvis/io/tequila/__init__.py |
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jarvis/io/tequila/inputs.py |
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jarvis/io/vasp/__init__.py |
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jarvis/io/vasp/default_potcars.json |
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jarvis/io/vasp/inputs.py |
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jarvis/io/vasp/outputs.py |
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jarvis/io/wannier/__init__.py |
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jarvis/io/wannier/default_semicore.json |
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jarvis/io/wannier/inputs.py |
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jarvis/io/wannier/outputs.py |
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jarvis/io/wanniertools/__init__.py |
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jarvis/io/wanniertools/inputs.py |
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jarvis/io/wanniertools/outputs.py |
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jarvis/io/wien2k/__init__.py |
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jarvis/io/wien2k/inputs.py |
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jarvis/io/wien2k/outputs.py |
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jarvis/io/zeopp/__init__.py |
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jarvis/io/zeopp/inputs.py |
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jarvis/tasks/__init__.py |
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jarvis/tasks/queue_jobs.py |
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jarvis/tasks/boltztrap/__init__.py |
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jarvis/tasks/boltztrap/run.py |
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jarvis/tasks/lammps/__init__.py |
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jarvis/tasks/lammps/lammps.py |
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jarvis/tasks/lammps/templates/__init__.py |
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jarvis/tasks/lammps/templates/displace.mod |
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jarvis/tasks/lammps/templates/inelast.mod |
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jarvis/tasks/lammps/templates/inelast_min.mod |
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jarvis/tasks/lammps/templates/inelast_nobox.mod |
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