| nr |
titel |
auteur |
tijdschrift |
jaar |
jaarg. |
afl. |
pagina('s) |
type |
| 1 |
Analytical Hartree–Fock wave functions for the atoms Cs to Lr
|
Koga, Toshikatsu
|
|
2000
|
104 |
5 |
p. 411-413
|
artikel
|
| 2 |
A theoretical investigation of (−)-deprenyl (selegiline) as a radical scavenger
|
Nakai, Sachiko
|
|
2000
|
104 |
5 |
p. 398-406
|
artikel
|
| 3 |
Book Review
|
,
|
|
2000
|
104 |
5 |
p. 416
|
artikel
|
| 4 |
Calculation of three-center electric and magnetic multipole moment integrals using translation formulas for Slater-type orbitals
|
Guseinov, I. I.
|
|
2000
|
104 |
5 |
p. 407-410
|
artikel
|
| 5 |
Contracted basis sets for electrical property calculations derived from Second-order Møller–Plesset theory atomic natural orbitals
|
Russell, Anthony J.
|
|
2000
|
104 |
5 |
p. 385-391
|
artikel
|
| 6 |
Efficient electronic structure calculations for systems of one-dimensional periodicity with the restricted Hartree–Fock–linear combination of atomic orbitals method implemented in Fourier space
|
Flamant, I.
|
|
2000
|
104 |
5 |
p. 350-357
|
artikel
|
| 7 |
Erratum: Theor Chem Acc (1999) 103:163–166
|
,
|
|
2000
|
104 |
5 |
p. 414
|
artikel
|
| 8 |
Erratum: Theor Chem Acc (2000) DOI 10.1007/s002149900108
|
,
|
|
2000
|
104 |
5 |
p. 415
|
artikel
|
| 9 |
Interaction energies for the water dimer by supermolecular methods and symmetry-adapted perturbation theory: the role of bond functions and convergence of basis subsets
|
Torheyden, Martin
|
|
2000
|
104 |
5 |
p. 370-384
|
artikel
|
| 10 |
Linear scaling computation of the Fock matrix. III. Formation of the exchange matrix with permutational symmetry
|
Schwegler, Eric
|
|
2000
|
104 |
5 |
p. 344-349
|
artikel
|
| 11 |
Multiconfigurational expansions of density operators: equations of motion and their properties
|
Raab, A.
|
|
2000
|
104 |
5 |
p. 358-369
|
artikel
|
| 12 |
Obituary
|
Zerner, Michael C.
|
|
|
104 |
5 |
p. 335
|
artikel
|
| 13 |
Obituary
|
Zerner, Michael C.
|
|
2000
|
104 |
5 |
p. 335
|
artikel
|
| 14 |
The equivalence of bond-energy schemes and the determination of resonance energies
|
Melrose, Melvyn P.
|
|
2000
|
104 |
5 |
p. 392-397
|
artikel
|
| 15 |
The generalized hybrid orbital method for combined quantum mechanical/molecular mechanical calculations: formulation and tests of the analytical derivatives
|
Amara, Patricia
|
|
2000
|
104 |
5 |
p. 336-343
|
artikel
|
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