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Catalytic properties of small ruthenium particles deposited on carbon: Ammonia decomposition studies

Carbon (New York), 2003, Vol.41 (3), p.589-591

2003

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Use of approximate integrals in ab initio theory. An application in MP2 energy calculations

Chemical physics letters, 1993-06, Vol.208 (5), p.359-363

1993

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Catalytic properties of small ruthenium particles deposited on carbon

Carbon (New York), 2003, Vol.41 (3), p.589-591

2003

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Molecular gradients and hessians implemented in density functional theory

The Journal of chemical physics, 1993-01, Vol.98 (2), p.1398-1421

1993

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Analytic computation of energy derivatives - Relationships among partial derivatives of a variationally determined function

The Journal of chemical physics, 1986-05, Vol.84 (10), p.5645-5650

1986

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Rapid geometry optimization for semi-empirical molecular orbital methods

Chemical physics letters, 1971-08, Vol.10 (3), p.303-306

1971

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Energetics of the protonation of CO - Implications for the observation of HOC(+) in dense interstellar clouds

The Journal of chemical physics, 1984-10, Vol.81 (8), p.3603-3611

1984

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Ab initio prediction of the barrier height for abstraction of H from CH4 by OH

The Journal of chemical physics, 1993-06, Vol.98 (11), p.8852-8858

1993

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A theoretical study of Na(H2O)n(+) (n = 1-4)

The Journal of chemical physics, 1991-10, Vol.95 (7), p.5142-5148

1991

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The proton affinity of N2 and spectroscopic properties of N2H

Chemical physics, 1986-06, Vol.105 (1-2), p.87-96

1986

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The Polish–Ukrainian borderland against the background of European regions

The EU's New Borderland, 2017, p.80-143

2017

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Cross-border relations in the Polish–Ukrainian borderland

The EU's New Borderland, 2017, p.144-196

2017

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Perspectives on and challenges of Polish–Ukrainian cross-border cooperation in the context of geopolitical changes in Central and Eastern Europe

The EU's New Borderland, 2017, p.197-260

2017

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Poland and Ukraine against the background of changes in Central and Eastern Europe in the twentieth and twenty-first centuries

The EU's New Borderland, 2016

2016

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Conformational properties, torsional potential, and vibrational force field for methacryloyl fluoride - An ab initio investigation

The Journal of chemical physics, 1985-06, Vol.82 (11), p.5089-5098

1985

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Ab initio infrared and Raman spectra

The Journal of chemical physics, 1983-06, Vol.78 (12), p.7077-7092

1983

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A parallel vectorized implementation of triple excitations in CCSD(T) - Application to the binding energies of the AlH3, AlH2F, AlHF2 and AlF3 dimers

Chemical physics letters, 1991-04, Vol.178 (5-6), p.462-470

1991

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Ab initio structure, force constants, and vibrational frequencies of methylsilane and silane

Journal of the American Chemical Society, 1984-05, Vol.106 (11), p.3114-3118

Komornicki, Andrew

1984

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Decoupling scheme for a semiclassical treatment of electronic transitions in atom–diatom collisions: Real-valued trajectories and local analytic continuation

The Journal of chemical physics, 1976-07, Vol.65 (1), p.48-54

1976

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Transition structures for the Claisen rearrangement

Journal of the American Chemical Society, 1988-03, Vol.110 (7), p.2314-2315

1988

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Concerted hydrogen atom exchange between three HF molecules

The Journal of chemical physics, 1992-02, Vol.96 (4), p.2920-2925

1992

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Calculation of photoionization cross sections using ab-initio wavefunctions and the plane wave approximation

Chemical physics letters, 1975-03, Vol.31 (2), p.286-290

1975

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Analytical second derivatives for effective core potentials

Chemical physics letters, 1988-12, Vol.153 (1), p.76-81

1988

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Structure, vibrational spectrum, and energetics of the CH5(+) ion - A theoretical investigation

The Journal of chemical physics, 1987-05, Vol.86 (10), p.5625-5634

1987

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Accurate proton affinities : Ab initio proton binding energies for N2, CO, CO2, and CH4

The Journal of chemical physics, 1992-07, Vol.97 (2), p.1087-1094

1992

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Catalytic properties of small ruthenium particles deposited on carbon: Ammonia decomposition studies

Use of approximate integrals in ab initio theory. An application in MP2 energy calculations

Catalytic properties of small ruthenium particles deposited on carbon

Molecular gradients and hessians implemented in density functional theory

Analytic computation of energy derivatives - Relationships among partial derivatives of a variationally determined function

Rapid geometry optimization for semi-empirical molecular orbital methods

Energetics of the protonation of CO - Implications for the observation of HOC(+) in dense interstellar clouds

Ab initio prediction of the barrier height for abstraction of H from CH4 by OH

A theoretical study of Na(H2O)n(+) (n = 1-4)

The proton affinity of N2 and spectroscopic properties of N2H

The Polish–Ukrainian borderland against the background of European regions

Cross-border relations in the Polish–Ukrainian borderland

Perspectives on and challenges of Polish–Ukrainian cross-border cooperation in the context of geopolitical changes in Central and Eastern Europe

Poland and Ukraine against the background of changes in Central and Eastern Europe in the twentieth and twenty-first centuries

Conformational properties, torsional potential, and vibrational force field for methacryloyl fluoride - An ab initio investigation

Ab initio infrared and Raman spectra

A parallel vectorized implementation of triple excitations in CCSD(T) - Application to the binding energies of the AlH3, AlH2F, AlHF2 and AlF3 dimers

Ab initio structure, force constants, and vibrational frequencies of methylsilane and silane

Decoupling scheme for a semiclassical treatment of electronic transitions in atom–diatom collisions: Real-valued trajectories and local analytic continuation

Transition structures for the Claisen rearrangement

Concerted hydrogen atom exchange between three HF molecules

Calculation of photoionization cross sections using ab-initio wavefunctions and the plane wave approximation

Analytical second derivatives for effective core potentials

Structure, vibrational spectrum, and energetics of the CH5(+) ion - A theoretical investigation

Accurate proton affinities : Ab initio proton binding energies for N2, CO, CO2, and CH4

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