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5. Adapting algebraic diagrammatic construction schemes for the polarization propagator to multi-refere

Adapting algebraic diagrammatic construction schemes for the polarization propagator to multi-refere

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

【摘 要】

：

Most of chemistry,focuses on molecular reactions,in which chemical bonds are broken and formed,which naturally leads to substantial multi-reference character of the electronic wavefunction.

【作 者】

：

D.Lefrancois M.Wormit A.Dreuw 

【机 构】

：

Interdisciplinary Center for Scientific Computing,Ruprecht-Karls University,Im Neuenheimer Feld 368,

【出 处】

：

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

【发表日期】

：

2015年5期

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Most of chemistry,focuses on molecular reactions,in which chemical bonds are broken and formed,which naturally leads to substantial multi-reference character of the electronic wavefunction.

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