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Brian F. Yates

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Journal Articles

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2009
[j4]
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  - journals/jcc/BrookesGCSY09
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  - https://dblp.org/rec/journals/jcc/BrookesGCSY09
Nigel J. Brookes, David C. Graham, Gemma Christian, Robert Stranger, Brian F. Yates:
The influence of peripheral ligand bulk on nitrogen activation by three-coordinate molybdenum complexes - A theoretical study using the ONIOM method. J. Comput. Chem. 30(13): 2146-2156 (2009)
2008
[j3]
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Matthew A. Addicoat, Mark A. Buntine, Brian F. Yates, Gregory F. Metha:
Associative versus dissociative binding of CO to 4d transition metal trimers: A density functional study. J. Comput. Chem. 29(9): 1497-1506 (2008)
1998
[j2]
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  - journals/jcc/HertwigKY98
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Roland H. Hertwig, Wolfram Koch, Brian F. Yates:
Economical treatments of relativistic effects and electron correlation in WH6. J. Comput. Chem. 19(14): 1604-1611 (1998)
1996
[j1]
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  - journals/jcc/HeardY96
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George L. Heard, Brian F. Yates:
Hybrid supermolecule-polarizable continuum approach to solvation: Application to the mechanism of the Stevens rearrangement. J. Comput. Chem. 17(12): 1444-1452 (1996)

Conference and Workshop Papers

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2003
[c1]
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Brian F. Yates, Brian J. Duke:
Computational Quantum Chemistry Experiments via the Web. International Conference on Computational Science 2003: 132-141

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