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Harry Partridge

Veröffentlichungen von Harry Partridge zu Partridge, Harry ->
weitere Veröffentlichungen von Harry Partridge:
Near Hartree–Fock quality GTO basis sets for the second-row atoms (1987)
Near Hartree–Fock quality GTO basis sets for the first- and third-row atoms (1989)
Theoretical Study of the Low-Lying States of TiHe+, TiNe+, TiAr+, VAr+, CrHe+, CrAr+, FeHe+, FeAr+, CoHe+, and CoAr+ (1994)
Calculation of magnesium(1+)-ligand relative binding energies (1992)
Theoretical study of metal ions bound to helium, neon, and argon (1992)
Heat of Formation of CH2OH (1994)
The bonding of multiple ligands to magnesium(+) and aluminum(+) (1991)
A determination of magnesium(1+)-ligand binding energies (1991)
Theoretical determination of the ground state of nitrogen molecule dication (N22+) (1987)
High-quality Gaussian basis sets for fourth-row atoms (1992)
The determination of an accurate isotope dependent potential energy surface for water from extensive ab initio calculations and experimental data (1997)
Do bond functions help for the calculation of accurate bond energies? (1998)
A comparison of ZnO and ZnO− (1998)
Convergence testing of the analytic representation of an ab initio dipole moment function for water: Improved fitting yields improved intensities (2000)
Potential energy curves and transport properties for the interaction of He with other ground-state atoms (2001)
Veröffentlichungen zu Partridge, Harry [x]
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61
Bauschlicher, Charles W.. Theoretical study of the bonding of the first- and second-row transition-metal positive ions to methylene
In: The journal of physical chemistry . - Washington, DC : American Chemical Society, Vol. 96, No. 17 (1992), p. 6969-6973
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1992
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62
Sodupe, M.. Theoretical study of the bonding of the first-row transition-metal positive ions to ethylene. [Erratum to document cited in CA116(13):128993g]
In: The journal of physical chemistry . - Washington, DC : American Chemical Society, Vol. 96, No. 13 (1992), p. 5670-5670
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1992
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63
Partridge, Harry. Theoretical study of metal ions bound to helium, neon, and argon
In: The journal of physical chemistry . - Washington, DC : American Chemical Society, Vol. 96, No. 13 (1992), p. 5350-5355
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1992
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64
Bauschlicher, Charles W.. Theoretical study of transition-metal ions bound to benzene
In: The journal of physical chemistry . - Washington, DC : American Chemical Society, Vol. 96, No. 8 (1992), p. 3273-3278
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1992
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65
Bauschlicher, Charles W.. Theoretical study of chromium(1+) and cobalt(1+) bound to hydrogen and nitrogen
In: The journal of physical chemistry . - Washington, DC : American Chemical Society, Vol. 96, No. 6 (1992), p. 2475-2479
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1992
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66
Sodupe, M.. Theoretical study of the bonding of the first-row transition-metal positive ions to ethylene
In: The journal of physical chemistry . - Washington, DC : American Chemical Society, Vol. 96, No. 5 (1992), p. 2118-2122
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1992
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67
Shen, Mingzuo., Schaefer, Henry F.., ... Tungsten hexahydride (WH6). An equilibrium geometry far from octahedral
In: The Journal of Chemical Physics. - College Park, Md. : Inst., ISSN 1089-7690, Vol. 98, No. 1 (1993), p. 508-521
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1993
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68
Bauschlicher, Charles W.., Langhoff, Stephen R.., ... Theoretical study of the lowest 5Π and 5Σ+ states of CO
In: The Journal of Chemical Physics. - College Park, Md. : Inst., ISSN 1089-7690, Vol. 98, No. 11 (1993), p. 8785-8789
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1993
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69
Partridge, Harry., Schwenke, David W.., ... Theoretical study of the ground states of the rare-gas hydrides, HeH, NeH, and ArH
In: The Journal of Chemical Physics. - College Park, Md. : Inst., ISSN 1089-7690, Vol. 99, No. 12 (1993), p. 9776-9782
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1993
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70
Bauschlicher, Charles W.., Partridge, Harry., ... Franck–Condon factors for photodetachment from LiO−, NaO−, and KO−
In: The Journal of Chemical Physics. - College Park, Md. : Inst., ISSN 1089-7690, Vol. 99, No. 5 (1993), p. 3654-3658
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1993
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71
Partridge, Harry., Bauschlicher, Charles W.., ... Ab initio potential energy surface for H–H2
In: The Journal of Chemical Physics. - College Park, Md. : Inst., ISSN 1089-7690, Vol. 99, No. 8 (1993), p. 5951-5960
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1993
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72
Bauschlicher, Charles W., Partridge, Harry On the invariance of the configuration interaction energy with respect to orbital rotations
in: Theoretical chemistry accounts , ISSN 1432-2234, Vol. 85 (4. 1993), p. 255-259
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1993
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73
Bauschlicher, Charles W.. Determination of the structure and bond energies of nickel dioxide and copper dioxide
In: The journal of physical chemistry . - Washington, DC : American Chemical Society, Vol. 97, No. 4 (1993), p. 856-859
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1993
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74
Bauschlicher, Charles W.., Langhoff, Stephen R.., ... The low-lying states of AlCu and AlAg
In: The Journal of Chemical Physics. - College Park, Md. : Inst., ISSN 1089-7690, Vol. 100, No. 2 (1994), p. 1219-1225
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1994
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75
Bauschlicher, Charles W.., Partridge, Harry. How large is the effect of 1s correlation on the De, ωe, and re of N2?
In: The Journal of Chemical Physics. - College Park, Md. : Inst., ISSN 1089-7690, Vol. 100, No. 6 (1994), p. 4329-4335
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1994
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76
Bauschlicher, Charles W.., Langhoff, Stephen R.., ... A redetermination of the dissociation energy of MgO+
In: The Journal of Chemical Physics. - College Park, Md. : Inst., ISSN 1089-7690, Vol. 101, No. 3 (1994), p. 2644-2645
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1994
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77
Pradhan, Atul D.., Partridge, Harry., ... The dissociation energy of CN and C2
In: The Journal of Chemical Physics. - College Park, Md. : Inst., ISSN 1089-7690, Vol. 101, No. 5 (1994), p. 3857-3861
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1994
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78
Harry, E.J., Partridge, S.R., ... Conservation of the 168 divIB gene in Bacillus subtilis W23 and B. licheniformis, and evidence for homology to ftsQ of Escherichia coli
in: Gene, in: Gene . - Amsterdam : Elsevier, ISSN 0378-1119, ZDB-ID 1491012-3 Vol. 147, No. 1 (1994), p. 85-89
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1994
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79
Partridge, Harry. Theoretical Study of the Low-Lying States of TiHe+, TiNe+, TiAr+, VAr+, CrHe+, CrAr+, FeHe+, FeAr+, CoHe+, and CoAr+
In: The journal of physical chemistry . - Washington, DC : American Chemical Society, Vol. 98, No. 9 (1994), p. 2301-2306
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1994
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80
Bauschlicher, Charles W.. Heat of Formation of CH2OH
In: The journal of physical chemistry . - Washington, DC : American Chemical Society, Vol. 98, No. 7 (1994), p. 1826-1829
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1994