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• W2055149715 endingPage "1554" @default.
• W2055149715 startingPage "1549" @default.
• W2055149715 abstract "The zero field splitting parameter D is calculated for the ground state of NH (3Σg—) using a variety of single Slater-type atomic orbitals and atomic SCF functions for nitrogen. A minimal basis (five basis functions) one-center expansion SCF calculation has been performed for 3Σg— NH. The resulting molecular orbitals produce D=1.6279 cm−1. Spin—orbit contributions to D are estimated and found to be small." @default.
• W2055149715 created "2016-06-24" @default.
• W2055149715 creator A5014047488 @default.
• W2055149715 date "1965-03-01" @default.
• W2055149715 modified "2023-10-17" @default.
• W2055149715 title "Calculation of Zero Field Splitting in NH. I. One-Center Minimal Basis and Atomic Orbital Representations of the Ground State" @default.
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• W2055149715 doi "https://doi.org/10.1063/1.1696158" @default.
• W2055149715 hasPublicationYear "1965" @default.
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