Authors:
HROUDA V
CARSKY P
INGR M
CHVAL Z
SASTRY GN
BALLY T
Citation: V. Hrouda et al., THE C4H6-CENTER-DOT-ENERGY SURFACE - 2 - THE REACTION OF ETHYLENE RADICAL-CATION WITH ACETYLENE( POTENTIAL), The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 102(46), 1998, pp. 9297-9307
Citation: Gn. Sastry et al., THE C4H6-CENTER-DOT-ENERGY SURFACE - 1 - THE RING-OPENING REACTION OFCYCLOBUTENE RADICAL-CATION AND RELATED REARRANGEMENTS( POTENTIAL), Journal of the American Chemical Society, 120(36), 1998, pp. 9323-9334
Citation: V. Hrouda et al., THE C4H4-CENTER-DOT-ENERGY SURFACE .2. THE JAHN-TELLER STABILIZATION OF IONIZED TETRAHEDRANE AND ITS REARRANGEMENT TO CYCLOBUTADIENE RADICAL-CATION( POTENTIAL), The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 101(21), 1997, pp. 3918-3924
Citation: V. Hrouda et al., THE C(4)H(4)(CENTER-DOT-CATION()POTENTIAL ENERGY SURFACE .3. THE REACTION OF ACETYLENE WITH ITS RADICAL), The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 101(21), 1997, pp. 3925-3935
Authors:
CARSKY P
HROUDA V
POLASEK M
DAVID DE
ANTIC D
MICHL J
Citation: P. Carsky et al., CUBIC-GRID GAUSSIAN-BASIS SETS FOR ELECTRON-SCATTERING CALCULATIONS .6. APPLICATIONS TO H-2, H2O, AND CH4, The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 101(20), 1997, pp. 3754-3761
Citation: P. Carsky et al., NEW GENERAL FORMULAS FOR MATRIX-ELEMENTS OF THE FREE-PARTICLE GREENS-FUNCTION OVER CARTESIAN GAUSSIANS, Theoretica Chimica Acta, 93(1), 1996, pp. 49-59
Citation: P. Carsky et al., CUBIC-GRID GAUSSIAN-BASIS SETS FOR ELECTRON-SCATTERING CALCULATIONS .1. DEFINITION AND CONSTRUCTION, International journal of quantum chemistry, 53(4), 1995, pp. 419-429
Citation: P. Carsky et al., CUBIC-GRID GAUSSIAN-BASIS SETS FOR ELECTRON-SCATTERING CALCULATIONS .2. MATRIX-ELEMENTS, International journal of quantum chemistry, 53(4), 1995, pp. 431-436
Citation: P. Carsky et al., CUBIC-GRID GAUSSIAN-BASIS SETS FOR ELECTRON-SCATTERING CALCULATIONS .3. EFFECT OF BASIS-SET TRANSLATION AND SIZE ON THE CALCULATED CROSS-SECTION, International journal of quantum chemistry, 53(4), 1995, pp. 437-450
Authors:
CARSKY P
HROUDA V
SYCHROVSKY V
HUBAC I
BABINEC P
MACH P
URBAN J
MASIK J
Citation: P. Carsky et al., BRILLOUIN-WIGNER PERTURBATION-THEORY AS A POSSIBLE MORE EFFECTIVE ALTERNATIVE TO MANY-BODY RAYLEIGH-SCHRODINGER PERTURBATION-THEORY AND COUPLED-CLUSTER THEORY, Collection of Czechoslovak Chemical Communications, 60(9), 1995, pp. 1419-1428
Citation: V. Hrouda et al., CUBIC-GRID GAUSSIAN-BASIS SETS FOR ELECTRON-SCATTERING CALCULATIONS .4. DIFFERENTIAL CROSS-SECTION AVERAGING FOR ISOTROPIC SAMPLES, Theoretica Chimica Acta, 89(5-6), 1994, pp. 401-413
Citation: V. Hrouda et al., DOUBLE PROTON-TRANSFER - FROM THE FORMAMIDE DIMER TO THE ADENINE THYMINE BASE-PAIR, Journal of physical chemistry, 98(17), 1994, pp. 4742-4747
Citation: J. Florian et V. Hrouda, SCALED QUANTUM-MECHANICAL FORCE-FIELDS AND VIBRATIONAL-SPECTRA OF SOLID-STATE NUCLEIC-ACID CONSTITUENTS .5. THYMINE AND URACIL, Spectrochimica acta. Part A: Molecular spectroscopy, 49(7), 1993, pp. 921-938