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SAR and QSAR in Environmental Research
|
November 19, 2011
Chemical sub-structural cluster expansions for molecular properties
D J Klein, T G Schmalz, L Bytautas
The Journal of Chemical Physics
|
December 7, 2007
Accurate ab initio potential energy curve of F2. II. Core-valence correlations, relativistic contributions, and long-range interactions
L Bytautas, N Matsunaga, T Nagata, et al.
The Journal of Chemical Physics
|
December 7, 2007
Accurate ab initio potential energy curve of F2. III. The vibration rotation spectrum
L Bytautas, N Matsunaga, T Nagata, et al.
The Journal of Chemical Physics
|
July 23, 2004
Molecule intrinsic minimal basis sets. I. Exact resolution of ab initio optimized molecular orbitals in terms of deformed atomic minimal-basis orbitals
W C Lu, C Z Wang, M W Schmidt, et al.
The Journal of Chemical Physics
|
July 23, 2004
Molecule intrinsic minimal basis sets. II. Bonding analyses for Si4H6 and Si2 to Si10
W C Lu, C Z Wang, M W Schmidt, et al.
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Search research articles
Search
Showing results (1-10 of 5) with videos related to
Sort By:
Page
of 1
SAR and QSAR in Environmental Research
|
November 19, 2011
Chemical sub-structural cluster expansions for molecular properties
D J Klein, T G Schmalz, L Bytautas
The Journal of Chemical Physics
|
December 7, 2007
Accurate ab initio potential energy curve of F2. II. Core-valence correlations, relativistic contributions, and long-range interactions
L Bytautas, N Matsunaga, T Nagata, et al.
The Journal of Chemical Physics
|
December 7, 2007
Accurate ab initio potential energy curve of F2. III. The vibration rotation spectrum
L Bytautas, N Matsunaga, T Nagata, et al.
The Journal of Chemical Physics
|
July 23, 2004
Molecule intrinsic minimal basis sets. I. Exact resolution of ab initio optimized molecular orbitals in terms of deformed atomic minimal-basis orbitals
W C Lu, C Z Wang, M W Schmidt, et al.
The Journal of Chemical Physics
|
July 23, 2004
Molecule intrinsic minimal basis sets. II. Bonding analyses for Si4H6 and Si2 to Si10
W C Lu, C Z Wang, M W Schmidt, et al.
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