Martin Diehl
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ac0a20696c
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rename: grid -> cells
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2020-12-03 22:16:34 +01:00 |
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Philip Eisenlohr
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4877334986
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added getitem and where functionality to Table
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2020-12-02 19:25:54 -05:00 |
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Martin Diehl
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e15678e7a4
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consistent handling of comments
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2020-11-12 21:31:09 +01:00 |
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Martin Diehl
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5926f84851
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WIP: refactoring Orientation=Symmetry+Rotation, Lattice=subclass of Sym, and Crystal=Lattice+Rotation
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2020-11-09 21:20:56 +01:00 |
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Martin Diehl
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75401dd280
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generate configuration from table
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2020-10-09 07:45:20 +02:00 |
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Martin Diehl
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6ab88aad2b
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default format for Table is ASCII
hence, renamed load_ASCII/save_ASCII to load/save
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2020-09-20 20:45:06 +02:00 |
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Martin Diehl
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c935ba1215
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user friendly self reporting
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2020-09-18 16:23:23 +02:00 |
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Martin Diehl
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1849ff0330
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polishing
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2020-09-18 15:03:51 +02:00 |
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Philip Eisenlohr
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96ad358f83
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modified file reading/writing methods to load_X, save_X formalism
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2020-09-15 01:14:05 -04:00 |
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Martin Diehl
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f6758ecc28
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table class operates out of place
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2020-09-14 07:04:01 +02:00 |
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Philip Eisenlohr
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a4785ba562
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modified file writing of geom and table to a general to_file() that takes a "format=" argument
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2020-09-03 10:53:16 -04:00 |
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Martin Diehl
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0ceba2a6d3
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use central functionality
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2020-08-24 23:28:26 +02:00 |
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Martin Diehl
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6a748d2edf
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do not expand single strings into characters
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2020-06-28 11:19:18 +02:00 |
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Philip Eisenlohr
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9999560247
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easier understanding of from_ang data layout interpretation
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2020-06-24 18:36:43 -04:00 |
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Philip Eisenlohr
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14d3b7e66d
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more f-stringing
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2020-06-24 16:59:55 -04:00 |
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Philip Eisenlohr
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966b6f8007
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shapes init copes with integers instead of strict tuples; introduced f-strings
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2020-06-24 14:18:06 -04:00 |
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Martin Diehl
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bbce3456e8
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advise from pylint
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2020-03-22 22:30:38 +01:00 |
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Martin Diehl
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20a06840b0
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works also for arrays ...
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2020-03-21 11:07:21 +01:00 |
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Martin Diehl
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e390982be7
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clean first level structure
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2020-03-19 15:19:11 +01:00 |