(Q28273304)

1

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Mikhal Oren

2

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Onur Atasoylu

3

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Jan M L Martin

4

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Jurgen Gauss

Journal of Chemical Physics

6

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language of work or name

English

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publication date

1 March 2004

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published in

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volume

120

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page(s)

4129-41

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issue

9

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cites work

Basis-set convergence in correlated calculations on Ne, N2, and H2O

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A full coupled‐cluster singles and doubles model: The inclusion of disconnected triples

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A fifth-order perturbation comparison of electron correlation theories

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The calculation of small molecular interactions by the differences of separate total energies. Some procedures with reduced errors

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Towards standard methods for benchmark quality ab initio thermochemistry—W1 and W2 theory

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Assessment of W1 and W2 theories for the computation of electron affinities, ionization potentials, heats of formation, and proton affinities

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Heats of Formation of Alkali Metal and Alkaline Earth Metal Oxides and Hydroxides: Surprisingly Demanding Targets for High-Level ab Initio Procedures

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Ab initio total atomization energies of small molecules — towards the basis set limit

21 January 2018

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On the performance of large Gaussian basis sets for the computation of total atomization energies

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Basis set convergence study of the atomization energy, geometry, and anharmonic force field of SO2: The importance of inner polarization functions

21 January 2018

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Combined bond-polarization basis sets for accurate determination of dissociation energies

21 January 2018

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Spectroscopic quality ab initio potential curves for CH, NH, OH and HF. A convergence study

21 January 2018

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Heat of atomization of sulfur trioxide, SO3: a benchmark for computational thermochemistry

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An accurate ab initio quartic force field for ammonia

21 January 2018

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Electron affinities of the first- and second-row atoms: Benchmarkab initioand density-functional calculations

21 January 2018

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A Definitive Heat of Vaporization of Silicon through Benchmarkab InitioCalculations on SiF4

21 January 2018

1 reference