gauge-invariant atomic orbital
... 规范不变性 gauge invariance 规范不变原子轨道 gauge-invariant atomic orbital 规范不等式组 normalized system of inequalities ...
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规范不变原子轨道
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采用规范不变原子轨道GIAO法，计算它们的1H-NMR和13C-NMR化学位移值。
With the GIAO (gauge-independent atomic orbital) method, the 1H-NMR and 13C-NMR were also calculated theoretically.
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