2. 您的位置
3. 首页
4. 会议论文
5. Auxiliary basis sets for density fitting in explicitly correlated calculations:The atoms H-Ar

Auxiliary basis sets for density fitting in explicitly correlated calculations:The atoms H-Ar

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

【作 者】

：

S.Kritikou J.G.Hill 

【机 构】

：

Department of Chemistry,University of Sheffield,S3 7HF Sheffield

【出 处】

：

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

【发表日期】

：

2015年期

下载到本地 , 更方便阅读

下载此文 赞助VIP

声明 : 本文档内容版权归属内容提供方 , 如果您对本文有版权争议 , 可与客服联系进行内容授权或下架

论文部分内容阅读

其他文献

Rational design of the singlet fission molecules

会议

Efficient implementation of local excitation approximation for treating excited states of molecules

会议

Carboxyl induced Vo migration and its implication in DSSC

会议

Localization of molecular orbitals:from fragments to molecule

会议

New implement of internally contracted multi-reference configuration interaction

会议

Ground and excited states of [ReCl(CO)3(diimine)] and [W(CNAr)6] complexes:Computational spectroscop

会议

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

会议

Using deep neural networks to construct kinetic energy functional

会议

Solving the Schr(o)dinger equations by the FC-LSE method:application to some organic molecules.Ⅱ

会议

Nuclear quantum effect on the double proton transfer of the formamidine-formic acid complex:gas phas

会议