Index

_

__init__() (matminer.data_retrieval.retrieve_Citrine.CitrineDataRetrieval method) (matminer.data_retrieval.retrieve_MP.MPDataRetrieval method) (matminer.data_retrieval.retrieve_MongoDB.MongoDataRetrieval method) (matminer.descriptors.add_descriptors.AddDescriptor method) (matminer.figrecipes.matplotlib.plots.HeatMapPlot method) (matminer.figrecipes.matplotlib.plots.XYPlot method) (matminer.figrecipes.plotly.make_plots.PlotlyFig method) (matminer.learners.volume_predictor.ConditionalVolumePredictor method) (matminer.learners.volume_predictor.VolumePredictor method) (matminer.models.mechanical_properties.BulkModulus method) (matminer.models.mechanical_properties.Lames1stParam method) (matminer.models.mechanical_properties.PWaveModulus method) (matminer.models.mechanical_properties.ShearModulus method) (matminer.models.mechanical_properties.YM method) (matminer.models.mechanical_properties.YoungsModulus method) (matminer.models.sound_velocity.SoundVelocityModel method) (matminer.models.thermal_conductivity.CahillSimpleModel method)

A

absolute_band_positions_bpe() (in module matminer.descriptors.bandstructure_features)

add_pmgdescriptor_column() (matminer.descriptors.add_descriptors.AddDescriptor method) AddDescriptor (class in matminer.descriptors.add_descriptors)

B

band_center() (in module matminer.descriptors.composition_features) bar_chart() (matminer.figrecipes.plotly.make_plots.PlotlyFig method) branch_point_energy() (in module matminer.descriptors.bandstructure_features)

brittleness_index() (in module matminer.models.mechanical_properties) bulk_modulus() (in module matminer.models.mechanical_properties) BulkModulus (class in matminer.models.mechanical_properties) bulkmodulus_coordination() (in module matminer.models.mechanical_properties)

C

cahill_integrand() (in module matminer.models.thermal_conductivity) cahill_integrand_model() (in module matminer.models.thermal_conductivity) cahill_integrand_summation() (in module matminer.models.thermal_conductivity) CahillSimpleModel (class in matminer.models.thermal_conductivity) calculate() (matminer.models.mechanical_properties.BulkModulus method) (matminer.models.mechanical_properties.Lames1stParam method) (matminer.models.mechanical_properties.PWaveModulus method) (matminer.models.mechanical_properties.ShearModulus method) (matminer.models.mechanical_properties.YM method) (matminer.models.mechanical_properties.YoungsModulus method) (matminer.models.thermal_conductivity.CahillSimpleModel method)

callaway_integrand() (in module matminer.models.thermal_conductivity) callaway_model() (in module matminer.models.thermal_conductivity) citation() (matminer.models.sound_velocity.SoundVelocityModel method) CitrineDataRetrieval (class in matminer.data_retrieval.retrieve_Citrine) clarke_model() (in module matminer.models.thermal_conductivity) clean_projection() (in module matminer.data_retrieval.retrieve_MongoDB) compute() (matminer.models.sound_velocity.SoundVelocityModel method) ConditionalVolumePredictor (class in matminer.learners.volume_predictor) ConditionalVolumePredictorTest (class in matminer.learners.tests.test_volume_predictor) critical_fracture_toughness() (in module matminer.models.mechanical_properties) critical_stress() (in module matminer.models.mechanical_properties)

D

debye_model() (in module matminer.models.thermal_conductivity)

E

effective_cubic_elasticconstant() (in module matminer.models.sound_velocity) equation() (matminer.models.mechanical_properties.BulkModulus method) (matminer.models.mechanical_properties.Lames1stParam method) (matminer.models.mechanical_properties.PWaveModulus method) (matminer.models.mechanical_properties.ShearModulus method) (matminer.models.mechanical_properties.YM method) (matminer.models.mechanical_properties.YoungsModulus method)

F

flattenDict() (in module matminer.utils)

fracture_toughness() (in module matminer.models.mechanical_properties)

G

get_cohesive_energy() (in module matminer.descriptors.composition_features) get_coulomb_matrix() (in module matminer.descriptors.structure_features) get_dataframe() (matminer.data_retrieval.retrieve_Citrine.CitrineDataRetrieval method) (matminer.data_retrieval.retrieve_MP.MPDataRetrieval method) (matminer.data_retrieval.retrieve_MongoDB.MongoDataRetrieval method) get_density() (in module matminer.descriptors.structure_features) get_holder_mean() (in module matminer.descriptors.composition_features) get_magpie_descriptor() (in module matminer.descriptors.composition_features) get_min_relative_distances() (in module matminer.descriptors.structure_features) get_neighbors_of_site_with_index() (in module matminer.descriptors.structure_features) get_okeeffe_distance_prediction() (in module matminer.descriptors.structure_features) get_okeeffe_params() (in module matminer.descriptors.structure_features)

get_order_parameter_stats() (in module matminer.descriptors.structure_features) get_order_parameters() (in module matminer.descriptors.structure_features) get_packing_fraction() (in module matminer.descriptors.structure_features) get_prdf() (in module matminer.descriptors.structure_features) get_predicted_structure() (matminer.learners.volume_predictor.ConditionalVolumePredictor method) (matminer.learners.volume_predictor.VolumePredictor method) get_pymatgen_descriptor() (in module matminer.descriptors.composition_features) get_rdf() (in module matminer.descriptors.structure_features) get_rdf_peaks() (in module matminer.descriptors.structure_features) get_redf() (in module matminer.descriptors.structure_features) get_value() (matminer.data_retrieval.retrieve_Citrine.CitrineDataRetrieval method) get_vol_per_site() (in module matminer.descriptors.structure_features)

H

heatmap_plot() (matminer.figrecipes.plotly.make_plots.PlotlyFig method)

HeatMapPlot (class in matminer.figrecipes.matplotlib.plots) histogram() (matminer.figrecipes.plotly.make_plots.PlotlyFig method)

I

is_int() (in module matminer.data_retrieval.retrieve_MongoDB)

is_ox() (in module matminer.learners.volume_predictor)

K

keyes_model() (in module matminer.models.thermal_conductivity)

L

Lames1stParam (class in matminer.models.mechanical_properties)

M

matminer (module) matminer.data_retrieval (module) matminer.data_retrieval.retrieve_Citrine (module) matminer.data_retrieval.retrieve_MongoDB (module) matminer.data_retrieval.retrieve_MP (module) matminer.descriptors (module) matminer.descriptors.add_descriptors (module) matminer.descriptors.bandstructure_features (module) matminer.descriptors.composition_features (module) matminer.descriptors.structure_features (module) matminer.figrecipes (module) matminer.figrecipes.matplotlib (module) matminer.figrecipes.matplotlib.examples (module) matminer.figrecipes.matplotlib.plots (module)

matminer.figrecipes.plotly (module) matminer.figrecipes.plotly.make_plots (module) matminer.learners (module) matminer.learners.tests (module) matminer.learners.tests.test_volume_predictor (module) matminer.learners.volume_predictor (module) matminer.models (module) matminer.models.mechanical_properties (module) matminer.models.sound_velocity (module) matminer.models.thermal_conductivity (module) matminer.utils (module) max_allowed_heatflow() (in module matminer.models.mechanical_properties) MongoDataRetrieval (class in matminer.data_retrieval.retrieve_MongoDB) MPDataRetrieval (class in matminer.data_retrieval.retrieve_MP)

P

parse_matrix() (matminer.data_retrieval.retrieve_Citrine.CitrineDataRetrieval method) parse_scalars() (matminer.data_retrieval.retrieve_Citrine.CitrineDataRetrieval method) parse_vectors() (matminer.data_retrieval.retrieve_Citrine.CitrineDataRetrieval method) plot() (matminer.figrecipes.matplotlib.plots.HeatMapPlot method) (matminer.figrecipes.matplotlib.plots.XYPlot method) PlotlyFig (class in matminer.figrecipes.plotly.make_plots) predict() (matminer.learners.volume_predictor.ConditionalVolumePredictor method) (matminer.learners.volume_predictor.VolumePredictor method)

properties_involved() (matminer.models.mechanical_properties.BulkModulus method) (matminer.models.mechanical_properties.Lames1stParam method) (matminer.models.mechanical_properties.PWaveModulus method) (matminer.models.mechanical_properties.ShearModulus method) (matminer.models.mechanical_properties.YoungsModulus method) PWaveModulus (class in matminer.models.mechanical_properties)

R

remove_ints() (in module matminer.data_retrieval.retrieve_MongoDB)

S

scatter_matrix() (matminer.figrecipes.plotly.make_plots.PlotlyFig method) shear_modulus() (in module matminer.models.mechanical_properties) ShearModulus (class in matminer.models.mechanical_properties) site_is_of_motif_type() (in module matminer.descriptors.structure_features) slack_integrand() (in module matminer.models.thermal_conductivity) slack_integrand_model() (in module matminer.models.thermal_conductivity)

slack_simple_model() (in module matminer.models.thermal_conductivity) sound_velocity() (in module matminer.models.sound_velocity) SoundVelocityModel (class in matminer.models.sound_velocity) steadystate_heatflow() (in module matminer.models.mechanical_properties) strain_energy_releaserate() (in module matminer.models.mechanical_properties) stress_from_tempgradient() (in module matminer.models.mechanical_properties)

T

test_CsCl() (matminer.learners.tests.test_volume_predictor.VolumePredictorTest method) test_CsCl_ionic() (matminer.learners.tests.test_volume_predictor.VolumePredictorTest method) test_predict() (matminer.learners.tests.test_volume_predictor.ConditionalVolumePredictorTest method)

test_Si() (matminer.learners.tests.test_volume_predictor.VolumePredictorTest method) thermal_shock() (in module matminer.models.mechanical_properties) thermal_stress() (in module matminer.models.mechanical_properties)

V

vickers_hardness1() (in module matminer.models.mechanical_properties) vickers_hardness2() (in module matminer.models.mechanical_properties)

violin_plot() (matminer.figrecipes.plotly.make_plots.PlotlyFig method) VolumePredictor (class in matminer.learners.volume_predictor) VolumePredictorTest (class in matminer.learners.tests.test_volume_predictor)

X

xy_plot() (matminer.figrecipes.plotly.make_plots.PlotlyFig method)

XYPlot (class in matminer.figrecipes.matplotlib.plots)

Y

YM (class in matminer.models.mechanical_properties)

YoungsModulus (class in matminer.models.mechanical_properties)