![]() This is now automatically corrected when reading the files into the program.įixed a possible crash when reading from a LAMMPS file with long atom label strings. Some older files were saved with their view directions inverted. Updated View Direction when loading a CrystalMaker binary file. Instead, vectors are plotted as defined by the input data, even if this means that some (extra-short) vectors will be hidden inside their host atom. When reading atom vector data ("AVEC" card) from a CrystalMaker text file, CrystalMaker no longer enforces a minimum vector length of 1.5 Å. Updated User's Guide, including notes on file synchronization and Apple's recent withdrawal of support for QuickTime for Windows. This version includes updated documentation, more-flexible import of atom vector data, plus a bug fix for LAMMPS file import. Sorting has been made smarter in this version, taking account of numerical suffices so that numbered views are sorted in a more human-readable manner (e.g., "10" appears after "2" and not before). This used a straightforward string comparison (e.g., "alpha" comes before "zulu"). Earlier versions of CrystalMaker allowed sorting of views in ascending or descending order, using the view labels. This allows up to 1-million unique atom IDs (from 0 to 999,999). In this version, CrystalMaker detects possible label overflow and will either truncate the symbol (prefix) to one character, or omit it entirely. Unfortunately, CrystalMaker's 6-character label limit can mean that labels end up being truncated - especially if they have a two-character element symbol as the prefix. ![]() In order to track atoms within these massive datasets, the atom label is required. ![]() Some users are working with massive structures, output as "dump" files from the LAMMPS program.
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