|
PAWpySeed
Parallel C/Python package for numerical analysis of PAW DFT wavefunctions
|
Variables | |
| list | filenames |
| list | names |
| dpaths | |
| list | defects = ["vac_1_Si", "sub_1_B_on_Si", "sub_1_P_on_Si", "sub_1_Cu_on_Si", "sub_1_S_on_Si"] |
| list | mathnames |
| list | charges = [[-2,-1,0,1,2], [-1,0], [0,1], [-1,0,1], [-2,-1,0,1,2,3]] |
| list | titles = [] |
| string | my_dir = '/home/kyle/Research/projects/researchpapers/pawpyseed/thesis/results/projections' |
| f = open('bandedges2.json', 'r') | |
| bandedges = yaml.load(f) | |
| be = bandedges[dp] | |
| bc = BulkCharacter.from_yaml(fname) | |
| efermi | |
| vbm | |
| cbm | |
| name | |
| spinpol | |
| True | |
| title | |
| pawpyseed.analysis.prep.bandedges = yaml.load(f) |
| pawpyseed.analysis.prep.bc = BulkCharacter.from_yaml(fname) |
| pawpyseed.analysis.prep.be = bandedges[dp] |
| pawpyseed.analysis.prep.cbm |
| list pawpyseed.analysis.prep.charges = [[-2,-1,0,1,2], [-1,0], [0,1], [-1,0,1], [-2,-1,0,1,2,3]] |
| list pawpyseed.analysis.prep.defects = ["vac_1_Si", "sub_1_B_on_Si", "sub_1_P_on_Si", "sub_1_Cu_on_Si", "sub_1_S_on_Si"] |
| pawpyseed.analysis.prep.dpaths |
| pawpyseed.analysis.prep.efermi |
| pawpyseed.analysis.prep.f = open('bandedges2.json', 'r') |
| list pawpyseed.analysis.prep.filenames |
| list pawpyseed.analysis.prep.mathnames |
| string pawpyseed.analysis.prep.my_dir = '/home/kyle/Research/projects/researchpapers/pawpyseed/thesis/results/projections' |
| pawpyseed.analysis.prep.name |
| pawpyseed.analysis.prep.names |
| pawpyseed.analysis.prep.spinpol |
| pawpyseed.analysis.prep.title |
| list pawpyseed.analysis.prep.titles = [] |
| pawpyseed.analysis.prep.True |
| pawpyseed.analysis.prep.vbm |
1.8.11