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What is not required to make a single molecule magnet [Score: 100%]
Author / Editor: Neese, Frank; Pantazis, Dimitrios A. |  Place of publication: Cambridge |  Publisher: Royal Society of Chemistry |  Year of Publication: 2011 | 10 s.
Journal / Series / Collection: Spectroscopy, theory and mechanism in bioinorganic chemistry (Faraday discussions, Vol. 148)
Subject Area: Chemie und Pharmazie; Physik
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Efficient and accurate local approximations to coupled-electron pair approaches : an attempt to revive the pair natural orbital method; 11 [Score: 100%]
Author / Editor: Neese, Frank; Hansen, Andreas; Wennmohs, Frank |  Place of publication: Melville, NY |  Publisher: American Institute of Physics |  Year of Publication: 2009 | 18 s.
Journal / Series / Collection: The journal of chemical physics; 130
Subject Area: Physik; Chemie und Pharmazie
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Prediction of electron paramagnetic resonance g values using coupled perturbed Hartree–Fock and Kohn–Sham theory; 24 [Score: 100%]
Author / Editor: Neese, Frank |  Place of publication: Melville, NY |  Publisher: American Institute of Physics |  Year of Publication: 2001 | 17 s.
Journal / Series / Collection: The journal of chemical physics; 115
Subject Area: Chemie und Pharmazie; Physik
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Efficient and accurate approximations to the local coupled cluster singles doubles method using a truncated pair natural orbital basis; 6 [Score: 100%]
Author / Editor: Neese, Frank; Hansen, Andreas; Liakos Dimitrios |  Place of publication: Melville, NY |  Publisher: American Institute of Physics |  Year of Publication: 2009 | 15 s.
Journal / Series / Collection: The journal of chemical physics; 131
Subject Area: Physik; Chemie und Pharmazie
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A spectroscopy oriented configuration interaction procedure; 18 [Score: 100%]
Author / Editor: Neese, Frank |  Place of publication: Melville, NY |  Publisher: American Institute of Physics |  Year of Publication: 2003 | 16 s.
Journal / Series / Collection: The journal of chemical physics; 119
Subject Area: Physik
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Metal and ligand hyperfine couplings in transition metal complexes : the effect of spin–orbit coupling as studied by coupled perturbed Kohn–Sham theory; 9 [Score: 100%]
Author / Editor: Neese, Frank |  Place of publication: Melville, NY |  Publisher: American Institute of Physics |  Year of Publication: 2003 | 10 s.
Journal / Series / Collection: The journal of chemical physics; 118
Subject Area: Physik
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