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- Q58201159 description "article" @default.
- Q58201159 description "im November 2012 veröffentlichter wissenschaftlicher Artikel" @default.
- Q58201159 description "wetenschappelijk artikel" @default.
- Q58201159 description "наукова стаття, опублікована в листопаді 2012" @default.
- Q58201159 name "Why the Standard B3LYP/6-31G* Model Chemistry Should Not Be Used in DFT Calculations of Molecular Thermochemistry: Understanding and Correcting the Problem" @default.
- Q58201159 name "Why the Standard B3LYP/6-31G* Model Chemistry Should Not Be Used in DFT Calculations of Molecular Thermochemistry: Understanding and Correcting the Problem" @default.
- Q58201159 type Item @default.
- Q58201159 label "Why the Standard B3LYP/6-31G* Model Chemistry Should Not Be Used in DFT Calculations of Molecular Thermochemistry: Understanding and Correcting the Problem" @default.
- Q58201159 label "Why the Standard B3LYP/6-31G* Model Chemistry Should Not Be Used in DFT Calculations of Molecular Thermochemistry: Understanding and Correcting the Problem" @default.
- Q58201159 prefLabel "Why the Standard B3LYP/6-31G* Model Chemistry Should Not Be Used in DFT Calculations of Molecular Thermochemistry: Understanding and Correcting the Problem" @default.
- Q58201159 prefLabel "Why the Standard B3LYP/6-31G* Model Chemistry Should Not Be Used in DFT Calculations of Molecular Thermochemistry: Understanding and Correcting the Problem" @default.
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- Q58201159 P1476 "Why the standard B3LYP/6-31G* model chemistry should not be used in DFT calculations of molecular thermochemistry: understanding and correcting the problem" @default.
- Q58201159 P2093 "Stefan Grimme" @default.
- Q58201159 P304 "10824-10834" @default.
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- Q58201159 P356 "10.1021/JO302156P" @default.
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