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Calculation of Magnetic Susceptibility and Proton Shielding in Methane

✍ Scribed by Hegstrom, Roger

Book ID
120244562
Publisher
American Institute of Physics
Year
1967
Tongue
English
Weight
578 KB
Volume
46
Category
Article
ISSN
0021-9606

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Ab initio calculation of magnetic shield
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✍ MatjaΕΎ Ε½aucer; Danilo Pumpernik; Milan Hladnik; Andrej AΕΎman πŸ“‚ Article πŸ“… 1976 πŸ› Elsevier Science 🌐 English βš– 223 KB

The magnetic susccptibdlty of hydrogen f!uorldc -s c.llculdtcd with four dlffcrcnt basis sets ofg:nugc invariant atomic orbit& (GIAO'F). Tbc Rooth.ran equations arc colvcd for various vcllucs of the magnetic field strcn,gtb and the susccptlbdrty is dcduccd by .I numerical differcnti.ltIon of the cnc