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Carl F. Melius

Sandia National Laboratories

107

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BAC-MP4 Predictions of Thermochemistry of Period IV Compounds; Indium, Tin and Antimony.

2006
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Bond Additivity Corrections for G3B3 and G3MP2B3 Quantum Chemistry Methods

2005 Journal of Physical Chemistry A
- Bharthwaj Anantharaman
- Carl F. Melius
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BAC-G2 predictions of thermochemistry for gas-phase aluminum compounds

2002 Journal of Physical Chemistry A
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Decomposition of HMX at Extreme Conditions: A Molecular Dynamics Simulation

2002 Journal of Physical Chemistry A
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Bond additivity corrections for quantum chemistry methods

1999 Journal of Physical Chemistry A
- Carl F. Melius
- Mark D. Allendorf
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Bond additivity corrections for quantum chemistry methods

1999
- Carl F. Melius
- Mark D. Allendorf
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Gallium compounds, a possible problem for the G2 approaches

1999 Journal of Chemical Physics
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RATE CONSTANT OF THE HONO + HONO - H2O + NO + NO2 REACTION FROM AB INITIO MO AND TST CALCULATIONS

1998 Journal of Physical Chemistry A
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Aromatic and polycyclic aromatic hydrocarbon formation in a laminar premixed n-butane flame

1998 Combustion and Flame
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Thermochemistry and Kinetics of Gas-Phase Reactions Relevant to the CVD of Coatings: New Data for Process Models

1998 MRS Proceedings
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Citations (1)