upxo.pxtal.polycrystal module

class upxo.pxtal.polycrystal.PolyXTAL[source]

Bases: object

Top-level polycrystal data container for UPXO.

Holds grain structure data (GSD), material property data (MPD), feature ID databases, flag arrays, and geometric parameter tables for multi-level (L0/L1/L2) hierarchical grain structures including twins, grain-boundary zones, prior-austenitic packets, and laths.

PXID = None

MPD = None

GSD = None

origin = None

xbase = None

ybase = None

zbase = None

x = None

y = None

z = None

xpert = None

ypert = None

zpert = None

L0GS_PolyXTAL = 1

L0GS_NGrains = None

G0 = None

GE0 = None

GV0 = None

Ng0 = None

Nge0 = None

Ngv0 = None

Precipitates = None

ID0_base = None

ID0_pair = None

ID1_base = None

ID1_pair = None

ID_ctex = None

PX_flags = None

GR_flags = None

GGP2A = None

GGP2L = None

property setcmdlHouseKeepingRules: House keeping rules related values.

property template_PXID: Template pxid.

property setPXID: Setpxid.

make_USTRs()[source]: Build and return USTRs.

set_gs_UID()[source]: Set or update gs UID.

set_ct_UID()[source]: Set or update ct UID.

property setupL1GS: Set details of the Level 1 poly-xtal.

property template_flag_level1gs: Template flag level1gs.

set_flag_level1gs()[source]: Set or update flag level1gs.

property templateGBZData: Templategbzdata.

setGBZData()[source]: Setgbzdata.

property templateTwinData: Templatetwindata.

setTwinData()[source]: Settwindata.

property templatePAPData: Templatepapdata.

setPAPData()[source]: Setpapdata.

property templateSubGrainData: Templatesubgraindata.

property setupL2GS: Set details of the Level 2 poly-xtal

property templateLathData: Templatelathdata.

setLathData()[source]: Setlathdata.

property templateParticleData: Templateparticledata.

setParticleData()[source]: Setparticledata.

property templateParticleClusterData: Templateparticleclusterdata.

setParticleClusterData()[source]: Setparticleclusterdata.

property template_ID0_base

px.make_ID0_base

Type:: CALL

property template_ID0_pair

px.make_ID0_pair

Type:: CALL

property template_ID1_base

px.make_ID1_base

Type:: CALL

property template_ID1_pair

px.make_ID1_pair

Type:: CALL

property template_ID_ctex

px.make_ID_ctex

Type:: CALL

property template_PX_flags

px.make_PX_flags

Type:: CALL

property template_GR_flags

px.make_GR_flags

Type:: CALL

property template_GGP2A: Grain Geometry Parameter - area CALL: px.make_GGP2A

property template_GGP2L

Grain geometry parameter - length (grain boundary length data).

Stores all raw data related to grain boundary length. Dictionary key layout:

all_ungrouped_l0   : id-length pairs for all edges in L0 PolyXTAL
all_ungrouped_l1   : id-length pairs for all edges in L1 PolyXTAL
all_ungrouped_l2   : id-length pairs for all edges in L2 PolyXTAL
all_ungrouped_l3   : id-length pairs for all edges in L3 PolyXTAL (future)
all_ungrouped_gbz  : id-length pairs for grain-boundary-zone edges
all_ungrouped_twin : id-length pairs for twin edges
all_ungrouped_papa : id-length pairs for pap edges
all_ungrouped_lath : id-length pairs for lath edges
all_ungrouped_part : id-length pairs for particle edges
all_grouped_l0_g   : per grainID -> [[edge_ID, length], ...]  (L0)
all_grouped_l1_g   : per grainID -> [[edge_ID, length], ...]  (L1)
all_grouped_l2_g   : per grainID -> [[edge_ID, length], ...]  (L2)
all_grouped_gbz    : per gbzID   -> [[edge_ID, length], ...]
all_grouped_gebz   : per gbzID   -> [[EXT_edge_ID, length], ...]
all_grouped_gibz   : per gbzID   -> [[INT_edge_ID, length], ...]
all_grouped_gc     : per gcID    -> [[edge_ID, length], ...]
all_grouped_twin   : per twinID  -> [[edge_ID, length], ...]
all_grouped_pap    : per papID   -> [[edge_ID, length], ...]
all_grouped_lath   : per lathID  -> [[edge_ID, length], ...]

CALL: px.make_GGP2L

property setPolyXTAL: Setpolyxtal.

property get_gsd: Return gsd.

property get_id0_base: Return id0_base.

property get_id0_pair: Return id0_pair.

property get_id1_base: Return id1_base.

property get_id1_pair: Return id1_pair.

property get_id_ctex: Return id_ctex.

property get_flags_px: Return flags_px.

property get_flags_gr: Return flags_gr.

property get_ggp2a: Return ggp2a.

property get_ggp2l: Return ggp2l.

property get_dimensionality: Return dimensionality.

property get_MorphGenTech: Return MorphGenTech.

property get_ni_level0: Return ni_level0.

property get_ni_level1: Return ni_level1.

property get_ni_level2: Return ni_level2.

property get_ni_texos: Return ni_texos.

property get_ni_texps: Return ni_texps.

property get_id0_g: Return id0_g.

property get_id0_s: Return id0_s.

property get_id0_e: Return id0_e.

property get_id0_j: Return id0_j.

property get_id0_gs: Return id0_gs.

property get_id0_ge: Return id0_ge.

property get_id0_gj: Return id0_gj.

property get_id0_sg: Return id0_sg.

property get_id0_eg: Return id0_eg.

property get_id0_jg: Return id0_jg.

property get_id0_se: Return id0_se.

property get_id0_sj: Return id0_sj.

property get_id0_es: Return id0_es.

property get_id0_js: Return id0_js.

property get_id0_ej: Return id0_ej.

property get_id0_je: Return id0_je.

property get_gbz: Return gbz.

property get_gbz_ebe: Return gbz_ebe.

property get_gbz_ibe: Return gbz_ibe.

property get_gbz_ebj: Return gbz_ebj.

property get_gbz_ibj: Return gbz_ibj.

property get_gc: Return gc.

property get_gc_ebe: Return gc_ebe.

property get_gc_ibe: Return gc_ibe.

property get_gc_ebj: Return gc_ebj.

property get_gc_ibj: Return gc_ibj.

property get_twin: Return twin.

property get_twinbed: Return twinbed.

property get_twinbjp: Return twinbjp.

property get_apckt: Return apckt.

property get_apcktbe: Return apcktbe.

property get_apcktbjp: Return apcktbjp.

GSvisualise()[source]: Gsvisualise.

pf()[source]: Pf.

ipf()[source]: Ipf.

odfSec()[source]: Odfsec.

ipfMap()[source]: Ipfmap.

makeFillerDataCTF()[source]: Makefillerdatactf.

writeCTF()[source]: Writectf.

genFEMesh()[source]: Genfemesh.

writeINP()[source]: Writeinp.

schmidTensor()[source]: Schmidtensor.