Relativistic configuration-interaction approach for Ab-initio calculation of the P-odd interaction c

来源 :The 15th ICQC International Congress of Quantum Chemistry(第1 | 被引量 : 0次 | 上传用户：Affiant_Donkey

【摘要】

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【作者】

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Manu Sikarwar Malaya K.Nayak

【机构】

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Department of Chemistry,Government College,Tonk-304001,India

【出处】

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The 15th ICQC International Congress of Quantum Chemistry(第1

【发表日期】

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2015年5期

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We present the result for the P-odd electron-nucleus interaction constant WA of YbF molecule in the ground(2Σ1/2) state,computed by using a fully relativistic restricted active space configuration-interaction method,which yields the result,WA = 543 Hz.,in reasonable agreement with previous calculations for symmetry violation constants[1-4].

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Relativistic configuration-interaction approach for Ab-initio calculation of the P-odd interaction c

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