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Results: 1-10 |
Results: 10
State-specific Brillouin-Wigner multireference coupled cluster study of the singlet-triplet separation in the tetramethyleneethane diradical
Authors: Pittner, J Nachtigall, P Carsky, P Hubac, I
Citation: J. Pittner et al., State-specific Brillouin-Wigner multireference coupled cluster study of the singlet-triplet separation in the tetramethyleneethane diradical, J PHYS CH A, 105(8), 2001, pp. 1354-1356
State-specific Brillouin-Wigner multireference coupled cluster study of the F-2 molecule: assessment of the a posteriori size-extensivity correction
Authors: Pittner, J Smydke, J Carsky, P Hubac, I
Citation: J. Pittner et al., State-specific Brillouin-Wigner multireference coupled cluster study of the F-2 molecule: assessment of the a posteriori size-extensivity correction, J MOL ST-TH, 547, 2001, pp. 239-244
Acidity of carboxylic acids: A rebuttal and redefinition
Authors: Exner, O Carsky, P
Citation: O. Exner et P. Carsky, Acidity of carboxylic acids: A rebuttal and redefinition, J AM CHEM S, 123(39), 2001, pp. 9564-9570
Perspective on "MO approach to electronic spectra of radicals" - Carsky P, Zahradnik R (1973) Top Curr Chem 43 : 1
Authors: Carsky, P Zahradnik, R
Citation: P. Carsky et R. Zahradnik, Perspective on "MO approach to electronic spectra of radicals" - Carsky P, Zahradnik R (1973) Top Curr Chem 43 : 1, THEOR CH AC, 103(3-4), 2000, pp. 315-316
Discrete momentum representation method for polar molecules: Calculation of the elastic electron scattering on the H2O molecule - art. no. 032703
Authors: Ingr, M Polasek, M Carsky, P Horacek, J
Citation: M. Ingr et al., Discrete momentum representation method for polar molecules: Calculation of the elastic electron scattering on the H2O molecule - art. no. 032703, PHYS REV A, 6203(3), 2000, pp. 2703
Discrete momentum representation of the Lippmann-Schwinger equation and its application to electron-molecule scattering - art. no. 032701
Authors: Polasek, M Jurek, M Ingr, M Carsky, P Horacek, J
Citation: M. Polasek et al., Discrete momentum representation of the Lippmann-Schwinger equation and its application to electron-molecule scattering - art. no. 032701, PHYS REV A, 6103(3), 2000, pp. 2701
Size-extensivity correction for the state-specific multireference Brillouin-Wigner coupled-cluster theory
Authors: Hubac, I Pittner, J Carsky, P
Citation: I. Hubac et al., Size-extensivity correction for the state-specific multireference Brillouin-Wigner coupled-cluster theory, J CHEM PHYS, 112(20), 2000, pp. 8779-8784
Multireference coupled-cluster calculations on the energy of activation inthe automerization of cyclobutadiene: Assessment of the state-specific multireference Brillouin-Wigner theory
Authors: Sancho-Garcia, JC Pittner, J Carsky, P Hubac, I
Citation: Jc. Sancho-garcia et al., Multireference coupled-cluster calculations on the energy of activation inthe automerization of cyclobutadiene: Assessment of the state-specific multireference Brillouin-Wigner theory, J CHEM PHYS, 112(20), 2000, pp. 8785-8788
B-k approximation applied to the multireference configuration interaction method
Authors: Sychrovsky, V Carsky, P Lischka, H
Citation: V. Sychrovsky et al., B-k approximation applied to the multireference configuration interaction method, INT J QUANT, 76(2), 2000, pp. 185-196
Assessment of the single-root multireference Brillouin-Wigner coupled-cluster method: Test calculations on CH2, SiH2, and twisted ethylene
Authors: Pittner, J Nachtigall, P Carsky, P Masik, J Hubac, I
Citation: J. Pittner et al., Assessment of the single-root multireference Brillouin-Wigner coupled-cluster method: Test calculations on CH2, SiH2, and twisted ethylene, J CHEM PHYS, 110(21), 1999, pp. 10275-10282
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