MPW1K Performs Much Better than B3LYP in DFT Calculations on Reactions that Proceed by Proton-Coupled Electron Transfer (PCET). (Q36844095)
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scientific article published on January 2006
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English | MPW1K Performs Much Better than B3LYP in DFT Calculations on Reactions that Proceed by Proton-Coupled Electron Transfer (PCET). |
scientific article published on January 2006 |
Statements
MPW1K Performs Much Better than B3LYP in DFT Calculations on Reactions that Proceed by Proton-Coupled Electron Transfer (PCET) (English)
Mark Lingwood
David A Hrovat
James M Mayer
Weston Thatcher Borden
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