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Effective mass?
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13
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2816
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June 24, 2022
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Question for calculating the Energy above hull
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2
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248
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June 23, 2022
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Write a unit cell to .xyz file with atoms on periodic boundaries?
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1
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297
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June 22, 2022
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Create video/gif from XDATCAR
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0
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98
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June 21, 2022
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Adding one H2 molecule on top of a slab
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0
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126
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June 20, 2022
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Lexicographic ordering of sites in a Structure
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1
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78
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June 16, 2022
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Crystal-toolkit in jupyter notebook: how to change display options
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0
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109
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June 13, 2022
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Is symprec in units of angstroms?
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3
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128
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June 11, 2022
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What does kppa stand for?
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0
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102
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June 10, 2022
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Problems with generating SQS structure for CuPd
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2
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144
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June 9, 2022
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Understanding weights in analysis.local_env classes voronoiNN and crystallNN
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2
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325
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June 8, 2022
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Unable to get all chemical potentials for GaAs using pymatgen
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4
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274
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May 28, 2022
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Failed to load vasprun.xml file
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0
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111
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May 24, 2022
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How to fetch Energy Cutoff Corrected Energy Final Energy/Atom from materials project using pymatgen?
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0
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85
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May 24, 2022
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'Figure' object has no attribute 'gcf'
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1
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401
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May 23, 2022
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Creating comination of Compounds using periodic table in a specific format
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2
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117
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May 22, 2022
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Vasprun having problems parsing Vasp 6.3 vasprun.xml files with ML on?
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2
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348
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May 19, 2022
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Transforming a structure with site probabilities into a define structure
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1
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116
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May 12, 2022
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Cannot make concurrent connections to MP legacy API
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0
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111
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May 12, 2022
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Cannot Import name 'coord_cython' from 'pymatgen.util'
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2
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487
|
May 12, 2022
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Electrostatic energy calculations to obtain optimized Dopant Site of a Slab
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0
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70
|
May 12, 2022
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Mp_api
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0
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86
|
May 11, 2022
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Query multiple chemical systems
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2
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234
|
May 10, 2022
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How to generate the VASP input files by using pymatgen
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3
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1059
|
May 5, 2022
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Want to create a list of All possible combination of ABO3 upto Cu-atom
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0
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88
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May 3, 2022
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Pourbaix Diagram Stable Entries - where does the hydrogen go?
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2
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127
|
April 28, 2022
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NotImplementedError when reading .mcif files of incommensurate structures with pymatgen
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0
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101
|
April 27, 2022
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How to increase slab thickness of an already terminated surface
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0
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97
|
April 22, 2022
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Surface slab visualization: Key Error 'O2-'
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3
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439
|
April 20, 2022
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Is it a bug or just something I need to do when use plot_slab function?
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2
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549
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April 20, 2022
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