The magnetizability and g-factor surfaces of ammonia
作者： Stephan P.A. Sauer , Vladimír Špirko , Jens Oddershede
DOI: 10.1016/0301-0104(91)90018-O
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摘要: Abstract First- and second-order polarization propagator calculations of magnetizability rotational g -factor property surfaces are reported for NH 3 . Only small effects using the method found. The molecular properties show large variations with HNH angle, but bond length. Ro-inversionally averaged calculated very good agreement is obtained some recent measurements (ν 2 , J, K ) a range ν quantum numbers.
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