Works matching IS 1432881X AND DT 2003 AND VI 109 AND IP 5
Results: 8
Two-electron distribution functions and intracules.
- Published in:
- Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2003, v. 109, n. 5, p. 241, doi. 10.1007/s00214-002-0411-5
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- Article
An ab initio study of the structure of two-, three- and five-dimersilicon clusters: An approach to the Si(100) surface.
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- Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2003, v. 109, n. 5, p. 268, doi. 10.1007/s00214-002-0420-4
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- Article
Influence of diffuse and polarization functions on the second-order Møller–Plesset optimized dihedral angle of biphenyl.
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- Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2003, v. 109, n. 5, p. 274, doi. 10.1007/s00214-003-0429-3
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- Article
Addendum to “Gaussian-3 and related methods for accuratethermochemistry,” L.A. Curtiss, K. Raghavachari (2002) Theoretical Chemistry Accounts 108:61–70.
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- Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2003, v. 109, n. 5, p. 239, doi. 10.1007/s00214-003-0430-x
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- Article
Relativistic and nonrelativistic finite nucleus optimized triple zeta basis sets for the 4p, 5p and 6p elements.
- Published in:
- 2003
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- Publication type:
- Erratum
Editorial note.
- Published in:
- Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2003, v. 109, n. 5, p. 240, doi. 10.1007/s00214-003-0436-4
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- Article
A thermodynamic and kinetic study of the formation of C<sub>20</sub> compounds encapsulating H, He and Ne atoms.
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- Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2003, v. 109, n. 5, p. 278, doi. 10.1007/s00214-003-0438-2
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- Article
Quantum molecular dynamics: propagating wavepackets and density operators using the multiconfiguration time-dependent Hartree method.
- Published in:
- Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2003, v. 109, n. 5, p. 251, doi. 10.1007/s00214-003-0439-1
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- Article