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Svein Saebo
Svein Saebo
Professor of Chemistry, Mississippi State University
Verifisert e-postadresse på msstate.edu
Tittel
Sitert av
Sitert av
År
Avoiding the integral storage bottleneck in LCAO calculations of electron correlation
S Sæbø, J Almlöf
Chemical Physics Letters 154 (1), 83-89, 1989
9061989
Local treatment of electron correlation
S Saebo, P Pulay
Annual Review of Physical Chemistry 44 (1), 213-236, 1993
9011993
Orbital-invariant formulation and second-order gradient evaluation in Møller-Plesset perturbation theory
P Pulay, S Saebø
Theoretica chimica acta 69, 357-368, 1986
6711986
Fourth‐order Mo/ller–Plessett perturbation theory in the local correlation treatment. I. Method
S Saebo/, P Pulay
The Journal of chemical physics 86 (2), 914-922, 1987
624*1987
Fourth‐order Mo/ller–Plessett perturbation theory in the local correlation treatment. I. Method
S Saebo/, P Pulay
The Journal of chemical physics 86 (2), 914-922, 1987
5461987
Local configuration interaction: An efficient approach for larger molecules
S Sæbø, P Pulay
Chemical physics letters 113 (1), 13-18, 1985
5061985
Efficient elimination of basis set superposition errors by the local correlation method: Accurate ab initio studies of the water dimer
S Saebo/, W Tong, P Pulay
The Journal of chemical physics 98 (3), 2170-2175, 1993
2941993
The structure of aniline by ab initio studies
Y Wang, S Saebø, CU Pittman Jr
Journal of Molecular Structure: THEOCHEM 281 (2-3), 91-98, 1993
214*1993
The weakly exothermic rearrangement of methoxy radical (CH3O) to the hydroxymethyl radical (CH2OH)
S Saebo/, L Radom, HF Schaefer III
The Journal of chemical physics 78 (2), 845-853, 1983
2101983
The weakly exothermic rearrangement of methoxy radical (CH" 3O/sup center-dot/) to the hydroxymethyl radical (CH" 2OH/sup center-dot/)
S Saebo, L Radom, HF Schaefer III
J. Chem. Phys, 1983
2101983
An efficient reformulation of the closed‐shell self‐consistent electron pair theory
P Pulay, S Saebo/, W Meyer
The Journal of chemical physics 81 (4), 1901-1905, 1984
2061984
Linear-scaling techniques in computational chemistry and physics: Methods and applications
R Zalesny, MG Papadopoulos, PG Mezey, J Leszczynski
Springer Netherlands, 2011
1232011
A low-scaling method for second order Møller–Plesset calculations
S Saebø, P Pulay
The Journal of Chemical Physics 115 (9), 3975-3983, 2001
1192001
Quantum chemistry in parallel with PQS
J Baker, K Wolinski, M Malagoli, D Kinghorn, P Wolinski, G Magyarfalvi, ...
Journal of Computational Chemistry 30 (2), 317-335, 2009
1062009
An ab initio study of potentially aromatic and antiaromatic three-membered rings
YG Byun, S Saebo, CU Pittman Jr
Journal of the American Chemical Society 113 (10), 3689-3696, 1991
1011991
Convex–concave stacking of curved conjugated networks: Benchmark calculations on the corannulene dimer
T Janowski, P Pulay, AAS Karunarathna, A Sygula, S Saebø
Chemical Physics Letters 512 (4-6), 155-160, 2011
752011
Two approaches to the computational determination of molecular structure: the torsional angle in tolane and the effect of fluorination on the structure of oxirane
S Saebø, J Almlöf, JE Boggs, JG Stark
Journal of Molecular Structure: THEOCHEM 200, 361-373, 1989
751989
π‐π Stacking of curved carbon networks: The corannulene dimer
A Sygula, S Saebø
International Journal of Quantum Chemistry 109 (1), 65-72, 2009
652009
Efficient calculation of canonical MP2 energies
P Pulay, S Saebo, K Wolinski
Chemical physics letters 344 (5-6), 543-552, 2001
622001
Fourth‐order Mo/ller–Plessett perturbation theory in the local correlation treatment. I. Method
P Pulay
The Journal of Chemical Physics 86 (2), 914-922, 1987
621987
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Artikler 1–20