Query: journal:(ChemPhysChem) title:(All-electron ab initio investigation of the electronic states of the PdC molecule), Author: Shim, ISSN: 14394235

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journal:(ChemPhysChem) title:(All-electron ab initio investigation of the electronic states of the PdC molecule) ISSN: 14394235 Author: Shim

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journal:ChemPhysChem AND title:(All-electron AND ab AND initio AND investigation AND of AND the AND electronic AND states AND of AND the AND PdC AND molecule)

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1 Journal article

All-electron ab initio investigation of the electronic states of the PdC molecule 10.1002/1439-7641(20010216)2:2<125::AID-CPHC125>3.0.CO;2-4

Shim, Irene; Gingerich, Karl A.

Chemphyschem — 2001, Volume 2, Issue 2, pp. 125-130

The electronic structure of transition metal containing molecules are extremely complicated and extensive calculations are required for reliable descriptions. In spite of this the results can often be interpreted in simple terms. The electronic structure of PdC is consistent with the molecular

Year: 2001

Language: English

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2 Article

All-Electron Ab Initio Investigation of the Electronic States of the PdC Molecule 10.1002/1439-7641(20010216)2:2<125::AID-CPHC125>3.0.CO;2-4