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Materials studio quasi random
Materials studio quasi random








It supports, for example: Ubuntu 14.04 and newer Debian 8 and newer CentOS 7 and newer etc. New version is compiled with relatively recent compilers and does not support obsolete Linux.

#Materials studio quasi random code

Dependency update: Supercell v1.x code binaries (from the site) can be run successfully on Linux distribution from 2008 year up to now and support all x86_64 processors younger than year 2005.Support for old compilers has been dropped. New C++ standard: Supercell code were updated to C++14 standard.Such approach allows to increase performance and treat ambiguous spacegroup information and inconsistency in CIF files much better. Reading and writing of CIF files now is done internally (thanks to gemmi library for cif parsing and spacegroup information). New I/O module: Supercell program doesn't use OpenBabel library for I/O and structures processing anymore.Randomness of output structures can be controlled by random-seed option. Additional scenarios: Supercell program can be used now for searching of high symmetry disorder supercell ( -n w option).The limit will be overcome with next release. In this release, you can gain from parallelization on up to 16 cores.

materials studio quasi random

Multi threading: Enumeration algorithm can run in parallel on shared memory architectures.Algorithms for symmetry search, electrostatic calculation, file I/O and, of course, structures enumeration became 4-10 times faster then previously. Performance boost: Almost half of the code was changed in the release to achieve a performance improvement.This is a major release with several significant changes: I'm proud to present you a new version of supercell program.








Materials studio quasi random