Electron correlation and relativity for functional materials

来源 :The 15th ICQC International Congress of Quantum Chemistry(第1 | 被引量 : 0次 | 上传用户：maxiao912

【摘要】

：

The inclusion of the effects of clcctron correlation and relativity may complicate accurate quantum chemical study of molecules and materials,on the other hand

【作者】

：

Ria Broer Coen de Graaf Remco Havenith Christel Marian Carmem Sousa

【机构】

：

ZernikeInstituteforAdvancedMaterials,UniversityofGroningen,TheNetherlandsZernikeInstituteforAdvanced

【出处】

：

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

【发表日期】

：

2015年6期

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The inclusion of the effects of clcctron correlation and relativity may complicate accurate quantum chemical study of molecules and materials,on the other hand these effects also allow for the design and synthesis of materials with fine-tuned physical properties.

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