검색결과 : 29건
No. | Article |
---|---|
1 |
BAC-MP4 predictions of thermochemistry for gas-phase indium compounds in the In-H-C-O-Cl system Skulan AJ, Nielsen IMB, Melius CF, Allendorf MD Journal of Physical Chemistry A, 110(1), 281, 2006 |
2 |
BAC-MP4 predictions of thermochemistry for gas-phase antimony compounds in the Sb-H-C-O-Cl system Skulan AJ, Nielsen IMB, Melius CF, Allendorf MD Journal of Physical Chemistry A, 110(17), 5919, 2006 |
3 |
Flame inhibition by phosphorus-containing compounds over a range of equivalence ratios Jayaweera TM, Melius CF, Pitz WJ, Westbrook CK, Korobeinichev OP, Shvartsberg VM, Shmakov AG, Rybitskaya IV, Curran HJ Combustion and Flame, 140(1-2), 103, 2005 |
4 |
Bond additivity corrections for G3B3 and G3MP2B3 quantum chemistry methods Anantharaman B, Melius CF Journal of Physical Chemistry A, 109(8), 1734, 2005 |
5 |
BAC-MP4 predictions of thermochemistry for gas-phase tin compounds in the Sn-H-C-Cl system Allendorf MD, Melius CF Journal of Physical Chemistry A, 109(22), 4939, 2005 |
6 |
BAC-G2 predictions of thermochemistry for gas-phase aluminum compounds Allendorf MD, Melius CF, Cosic B, Fontijn A Journal of Physical Chemistry A, 106(11), 2629, 2002 |
7 |
BAC-MP4 predictions of thermochemistry for gas-phase compounds in the Si-H-O-Cl system Allendorf MD, Melius CF Journal of Physical Chemistry A, 106(26), 6370, 2002 |
8 |
Decomposition of HMX at extreme conditions: A molecular dynamics simulation Manaa MR, Fried LE, Melius CF, Elstner M, Frauenheim T Journal of Physical Chemistry A, 106(39), 9024, 2002 |
9 |
Bond additivity corrections for quantum chemistry methods Melius CF, Allendorf MD Journal of Physical Chemistry A, 104(11), 2168, 2000 |
10 |
Gallium compounds, a possible problem for the G2 approaches Bauschlicher CW, Melius CF, Allendorf MD Journal of Chemical Physics, 110(4), 1879, 1999 |