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Cover Image, Volume 35, Issue 31
Publication year - 2014
Publication title -
journal of computational chemistry
Language(s) - English
Resource type - Reports
SCImago Journal Rank - 0.907
H-Index - 188
eISSN - 1096-987X
pISSN - 0192-8651
DOI - 10.1002/jcc.23768
Subject(s) - cover (algebra) , computer science , citation , code (set theory) , volume (thermodynamics) , image (mathematics) , grid , information retrieval , theoretical computer science , library science , artificial intelligence , mathematics , programming language , set (abstract data type) , physics , geometry , engineering , mechanical engineering , quantum mechanics
On page 2272 (DOI: 10.1002/jcc.23752 ), Jorge Garza and co‐workers report an efficient grid‐based algorithm to find critical points on the electron density, which scales very well on CPUs and exhibits a high performance on GPUs. The convenience in using this new proposal is evidenced when non‐nuclear attractors are found in a molecule and when the code is used on common GPUs, which are nondedicated to high‐performance applications. The cover was designed by Alfredo Garza.