A Hirshfeld interpretation of the charge, spin distribution, and polarity of the dipole moment of the open shell (3∑ -) nitrogen halides: NF, NCl, and NBr

Journal of Chemical Physics

Volumn 131, Issue 4, 2009, Pages

  Harrison, James F ^a  

^a MICHIGAN STATE UNIVERSITY   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

ATOMIC CHARGE; ATOMIC DIPOLE; BACK DONATION; DIPOLE MOMENT FUNCTIONS; ELECTRON DENSITIES; HIRSHFELD PARTITIONING; INTERNUCLEAR SEPARATION; INTRA-ATOMIC; MOLECULAR CHARGE; OPEN-SHELL; OPEN-SHELL MOLECULES; SPIN DISTRIBUTION; SPIN ELECTRONS; SPIN FLOW;

ATOMS; CHEMICAL BONDS; DIPOLE MOMENT; ELECTRIC DIPOLE MOMENTS; ELECTROMAGNETIC INDUCTION; ELECTRONEGATIVITY; ELECTRONS; HALOGEN ELEMENTS; SUPERCONDUCTING MATERIALS;

SPIN DYNAMICS;

EID: 68249098190     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.3190330     Document Type: Article

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