Methods for hartree-fock and density functional theory electronic structure calculations with linearly scaling processor time and memory usage

Challenges and Advances in Computational Chemistry and Physics

Volumn 13, Issue , 2011, Pages 263-300

  Rubensson, Emanuel H ^a   Rudberg, Elias ^a   Salek, Pawel ^b  

^a UPPSALA UNIVERSITY   (Sweden)

^b NONE   (Poland)

Author keywords

Density functional theory; Density matrix purification; Multipole approximations; Parametrized minimization; Sparse matrix; Two electron integrals

Indexed keywords

EID: 82555170122     PISSN: 25424491     EISSN: 25424483     Source Type: Book Series    
DOI: 10.1007/978-90-481-2853-2_12     Document Type: Chapter

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