Insights on spin polarization through the spin density source function.

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Spin density accuracy and distribution in azido Cu(II) complexes: A source function analysis.Source Function applied to experimental densities reveals subtle electron-delocalization effects and appraises their transferability properties in crystals

P2860

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P2860

Insights on spin polarization through the spin density source function.

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http://www.wikidata.org/entity/Q47106599

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2015 nî lūn-bûn

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2015年学术文章

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Insights on spin polarization through the spin density source function.

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Insights on spin polarization through the spin density source function.

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Item

label

Insights on spin polarization through the spin density source function.

@en

Insights on spin polarization through the spin density source function.

@nl

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Insights on spin polarization through the spin density source function.

@en

Insights on spin polarization through the spin density source function.

@nl

P1476

Insights on spin polarization through the spin density source function.

@en

P2093

Ahmed M Orlando

http://www.w3.org/2001/XMLSchema#string

P2860

A natural orbital diagnostic for multiconfigurational character in correlated wave functions

First spin-resolved electron distributions in crystals from combined polarized neutron and X-ray diffraction experiments

Magnetic sensing technology for molecular analyses

Electric-field control of ferromagnetism.

The QTAIM approach to chemical bonding between transition metals and carbocyclic rings: a combined experimental and theoretical study of (eta(5)-C5H5)Mn(CO)3, (eta(6)-C6H6)Cr(CO)3, and (E)-{(eta(5)-C5H4)CF=CF(eta(5)-C5H4)}(eta(5)-C5H5)2Fe2.

The charge density distribution in a model compound of the catalytic triad in serine proteases.

First-principles study of microporous magnets M-MOF-74 (M = Ni, Co, Fe, Mn): the role of metal centers.

Magnetic interactions in molecules and highly correlated materials: physical content, analytical derivation, and rigorous extraction of magnetic Hamiltonians.

Bonding quandary in the [Cu3S2]3+ core: insights from the analysis of domain averaged fermi holes and the local spin.

Testing the concept of hypervalency: charge density analysis of K2SO4.

P304

3845-3852

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P31

scholarly article

P356

10.1039/C4SC03988B

http://www.w3.org/2001/XMLSchema#string

P433

http://www.w3.org/2001/XMLSchema#string

P478

http://www.w3.org/2001/XMLSchema#string

P50

Leonardo Lo Presti

Carlo Gatti

P577

2015-04-14T00:00:00Z

http://www.w3.org/2001/XMLSchema#dateTime

P698

29218155

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P921

spin polarization

P932

5707457

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Insights on spin polarization through the spin density source function.

about

P2860

P2860

Insights on spin polarization through the spin density source function.

description

name

type

label

prefLabel

P1433

P1476

P2093

P2860

P304

P31

P356

P433

P478

P50

P577

P698

P921

P932

P356

P1433

P1476

P2093

P2860

P304

P31

P356

P433

P478

P50

P577

P698

P921

P932