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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. von Partridge, Harry.[x]
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61
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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62
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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63
Rosi, Marzio. Theoretical studies of the first- and second-row transition-metal dimethyls and their positive ions
In: The journal of physical chemistry . - Washington, DC : American Chemical Society, Vol. 94, No. 24 (1990), p. 8656-8663
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1990
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64
Langhoff, Stephen R.., Pettersson, Lars G. M.., ... Theoretical spectroscopic parameters for the low-lying states of the second-row transition metal hydrides
In: The Journal of Chemical Physics. - College Park, Md. : Inst., ISSN 1089-7690, Vol. 86, No. 1 (1987), p. 268-278
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1987
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65
Bauschlicher, Charles W.., Langhoff, Stephen R.., ... Mixed Cu–simple metal dimers and trimers: CuLi, CuLi2, CuNa, CuK, CuBe, CuBe2, Cu2Be, CuAl, and CuAl2
In: The Journal of Chemical Physics. - College Park, Md. : Inst., ISSN 1089-7690, Vol. 86, No. 10 (1987), p. 5603-5612
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1987
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66
Bauschlicher, Charles W.., Partridge, Harry., ... Accurate ab initio calculations which demonstrate a 3Πu ground state for Al2
In: The Journal of Chemical Physics. - College Park, Md. : Inst., ISSN 1089-7690, Vol. 86, No. 12 (1987), p. 7007-7012
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1987
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67
Pettersson, Lars G. M.., Bauschlicher, Charles W.., ... Positive ions of the first- and second-row transition metal hydrides
In: The Journal of Chemical Physics. - College Park, Md. : Inst., ISSN 1089-7690, Vol. 87, No. 1 (1987), p. 481-492
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1987
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68
Partridge, Harry., Langhoff, Stephen R.., ... Theoretical study of the A' 5Σ+g and C‘ 5Πu states of N2: Implications for the N2 afterglow
In: The Journal of Chemical Physics. - College Park, Md. : Inst., ISSN 1089-7690, Vol. 88, No. 5 (1988), p. 3174-3186
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1988
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69
Bauschlicher, Charles W.., Langhoff, Stephen R.., ... Theoretical study of the nitrogen atom hyperfine coupling constant
In: The Journal of Chemical Physics. - College Park, Md. : Inst., ISSN 1089-7690, Vol. 89, No. 5 (1988), p. 2985-2992
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1988
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70
Bauschlicher, Charles W.., Langhoff, Stephen R.., ... Theoretical studies of the first- and second-row transition-metal methyls and their positive ions
In: The Journal of Chemical Physics. - College Park, Md. : Inst., ISSN 1089-7690, Vol. 91, No. 4 (1989), p. 2399-2411
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1989
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71
Partridge, Harry., Bauschlicher, Charles W.., ... Theoretical study of the low-lying bound states of O2
In: The Journal of Chemical Physics. - College Park, Md. : Inst., ISSN 1089-7690, Vol. 95, No. 11 (1991), p. 8292-8300
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1991
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72
Bauschlicher, Charles W.., Langhoff, Stephen R.., ... A theoretical study of Na(H2O)+n (n=1–4)
In: The Journal of Chemical Physics. - College Park, Md. : Inst., ISSN 1089-7690, Vol. 95, No. 7 (1991), p. 5142-5148
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1991
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73
Stallcop, James R.., Bauschlicher, Charles W.., ... Theoretical study of hydrogen and nitrogen interactions: N–H transport cross sections and collision integrals
In: The Journal of Chemical Physics. - College Park, Md. : Inst., ISSN 1089-7690, Vol. 97, No. 8 (1992), p. 5578-5585
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1992
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74
Chong, Delano P.., Langhoff, Stephen R.., ... Theoretical dipole moments for the first-row transition metal hydrides
In: The Journal of Chemical Physics. - College Park, Md. : Inst., ISSN 1089-7690, Vol. 85, No. 5 (1986), p. 2850-2860
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1986
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75
Bauschlicher, Charles W.., Langhoff, Stephen R.., ... On the electron affinity of the oxygen atom
In: The Journal of Chemical Physics. - College Park, Md. : Inst., ISSN 1089-7690, Vol. 85, No. 6 (1986), p. 3407-3410
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1986
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76
Roth, Lisa M.. Heteronuclear diatomic metal cluster ions in the gas phase: theoretical treatment of magnesium-iron cation (MgFe+) and study of its reactions with hydrocarbons
In: American Chemical Society: Journal of the American Chemical Society. - Washington, DC : American Chemical Society, ISSN 1520-5126, Vol. 113, No. 9 (1991), p. 3274-3280
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1991
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77
Partridge, Harry., Bauschlicher, Charles W.., ... On the dissociation energy of Mg2
In: The Journal of Chemical Physics. - College Park, Md. : Inst., ISSN 1089-7690, Vol. 92, No. 9 (1990), p. 5377-5383
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1990