R. Kari

发表

Quality of Gaussian basis sets: Direct optimization of orbital exponents by the method of conjugate gradients

P. Mezey, I. Csizmadia, R. Kari, 1975 .

Ab initio calculations on sulfur‐containing compounds. II. One‐electron properties of H2S

R. Poirier, I. Csizmadia, R. Kari, 1984 .

A comparative molecular orbital study on the low lying singlet and triplet states of ethylene oxide

P. Mezey, I. Csizmadia, R. Kari, 1975 .

Gaussian wave functions for CH3 and NH 3

I. Csizmadia, R. Kari, 1972 .

Gaussian basis sets for nitrogen; Properties of NH3

R. Poirier, I. Csizmadia, R. Kari, 1985 .

The effects of optimization and scaling of AO exponents on molecular properties

P. Mezey, I. Csizmadia, R. Kari, 1977 .

AB Initio molecular orbital calculations on the si2h4molecule

R. Poirier, I. Csizmadia, R. Kari, 1978 .

Uniform quality Gaussian basis sets

P. Mezey, I. Csizmadia, R. Kari, 1977 .

Configuration Interaction Wavefunctions and Computed Inversion Barriers for NH3 and CH3

I. Csizmadia, R. Kari, 1972 .

Ab Initio SCF–MO–CI Calculations for H−, H2, and H3+ Using Gaussian Basis Sets

J. Polanyi, M. Robb, I. Csizmadia, 1970 .

An application of the method of conjugate gradients to the calculation of minimal basis set localized orbitals

R. Poirier, R. Kari, W. Ryback, 1978 .

Near‐Molecular Hartree—Fock Wavefunction for CH3−

I. Csizmadia, R. Kari, 1967 .

Handbook of Gaussian Basis Sets: A Compendium for Ab-Initio Molecular Orbital Calculations

R. Poirier, I. Csizmadia, R. Kari, 1985 .

A systematic study of the ionization potentials and electron, proton, hydrogen, and hydride affinities of OHn molecules and ions

I. Csizmadia, R. Kari, 1977 .

Dynamic link libraries in Windows 3.x

R. Kari, 1993 .

Parametrization and comparative analysis of the BFGS optimization algorithm for the determination of optimum linear coefficients

R. Kari, 1984 .

A comparison of one-electron properties calculated from Gaussian SCF and CI wavefunctions

I. Csizmadia, R. Kari, 1971 .

Potential‐Energy Surfaces of CH3+ and CH3−

I. Csizmadia, R. Kari, 1969 .