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    JANEČEK I., JANČA T., NAAR P., KALUS R., GADÉA F.X.
    Multiscale approach combining nonadiabatic dynamics with long-time radiative and non-radiative decay: Dissociative ionization of heavy rare-gas tetramers revisited
    JOURNAL OF CHEMICAL PHYSICS 138 (4): ART. NO. 044303, 2013.
    Abstract


    JANEČEK I., JANČA T., NAAR P., RENARD F., KALUS R., GADÉA F.X.
    Multiscale non-adiabatic dynamics with radiative decay, case study on the post-ionization fragmentation of rare-gas tetramers
    EUROPHYS. LETT. 98 (3), 33001, 2012
    Abstract


    KARLICKÝ F., LEPETIT B., KALUS R., GADÉA F. X.
    Vibrational spectrum of Ar3+ and relative importance of linear and perpendicular isomers in its photodissociation
    JOURNAL OF CHEMICAL PHYSICS 134 (8): ART. NO. 084305, 2011.
    Abstract


    SVRČKOVÁ P., VÍTEK A., KARLICKÝ F., PAIDAROVÁ I., KALUS R.
    Theoretical modeling of ionization energies of argon clusters - nuclear delocalization effects.
    JOURNAL OF CHEMICAL PHYSICS 134(22): ART. NO. 224310, 2011.
    Abstract


    KARLICKÝ F., OTYEPKA M.
    The First Step in the Reaction of Zerovalent Iron with Water
    J. CHEM. THEORY COMPUT. 7(9), 2876-2885, 2011
    Abstract


    VÍTEK A., PAIDAROVÁ I., KALUS R.
    Structural changes in the water tetramer. A combined Monte Carlo and DFT study.
    PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 12 (41): 13657, 2010
    Abstract


    OLEKSY K., KARLICKÝ F., KALUS R.
    Structures and energetics of helium cluster cations. Equilibrium geometries revisited through the genetic-algorithm approach.
    JOURNAL OF CHEMICAL PHYSICS 133 (16): ART. NO. 164314, 2010.
    Abstract


    P. PUKOWIECOVÁ, F. X. GADÉA, AND R. KALUS
    Photodissociation dynamics of ionic argon pentamer
    JOURNAL OF CHEMICAL PHYSICS 133 (21): ART. NO. 214302, 2010.
    Abstract


    ZBOŘIL R., KARLICKÝ F., BOURLINOS A.B., STERIOTIS T.A., STUBOS A.K., GEORGAKILAS V., ŠAFÁŘOVÁ K., JANČÍK D., TRAPALIS C., OTYEPKA M.
    Graphene fluoride: a stable stoichiometric graphene derivative and its chemical conversion to graphene
    SMALL 6 (24): 2885-2891, 2010.
    Abstract


    HRIVNAK D., KALUS R., GADEA F. X.
    Photodissociation dynamics of rare-gas ionic trimers
    PHYSICAL REVIEW A 79 (1): ART. NUM. 013424, 2009.
    Abstract


    JANEČEK I., CINTAVÁ S., HRIVŇÁK D., KALUS R., FÁRNÍK M., GADÉA F.
    Postionization fragmentation of rare-gas trimers revisited with new theoretical approaches
    JOURNAL OF CHEMICAL PHYSICS 131 (11): ART. NO. 114306, 2009.
    Abstract


    MILKO P., KALUS R., PAIDAROVÁ I., HRUŠÁK J., GADÉA F. X.
    Ab initio excited states calculations of Kr3+, probing semi-empirical modelling
    THEORETICAL CHEMISTRY ACCOUNTS 124 (3-4): 169, 2009.
    Abstract


    JANEČEK I., VAŠEK P.
    Anisotropic hall effect in single domain ybacuo superconductor in mixed state
    PHYSICA C 468 (1): 17-22, 2008.
    Abstrakt


    KARLICKY F., LEPETIT B., KALUS R., PAIDAROVA I., GADEA F. X.
    Modeling of He-N(+) clusters. II. Calculation of He-3(+) vibrational spectrum.
    JOURNAL OF CHEMICAL PHYSICS 128 (12): ART. NO. 124303, 2008.
    Abstract


    MALIJEVSKÝ AL., KARLICKÝ F., KALUS R., MALIJEVSKÝ A.
    Third Virial Coefficients of Argon from First Principles.
    JOURNAL OF PHYSICAL CHEMISTRY C 111 (43): 15565 -15568, 2007.
    Abstract


    PAIDAROVÁ I., POLÁK R., PAULÍKOVÁ B., KARLICKÝ F., OLEKSY K., HRIVŇÁK D., GADÉA F. X., KALUS R.
    Modeling of HeN+ clusters I. Ab initio and analytical potential energy surfaces for the ground state and two lowest excited states of He3+.
    CHEMICAL PHYSICS 342 (1-3): 64-70, 2007.
    Abstract


    KARLICKÝ F., LEPETIT B., KALUS R., GADÉA F. X.
    Calculation of argon trimer rovibrational spectrum
    JOURNAL OF CHEMICAL PHYSICS 126 (17): ART. NO. 174305, 2007.
    Abstract


    JANEČEK I., HRIVŇÁK D., KALUS R., GADÉA F. X.
    Theoretical modeling of postionization fragmentation of rare-gas trimer cations
    JOURNAL OF CHEMICAL PHYSICS 125 (10): ART. NO. 104315, 14 2006.
    Abstrakt


    KALUS R., HRIVŇÁK D., VÍTEK A.
    Modelling of Kr-n(+) clusters IV: Structural changes in Kr-3(+) and Kr-4(+)
    CHEMICAL PHYSICS 325 (2): 278-290, 2006.
    Abstract


    HRIVŇÁK D., KALUS R., GADEA F. X.
    Effect of the spin-orbit coupling in the dissociation dynamics of rare-gas ionic trimers
    EUROPHYSICS LETTERS 71 (1): 42-48, 2005.
    Abstrakt


    KALUS R., HRIVŇÁK D., PAŠKA P.
    Diatomics-in-molecules study of the photoabsorption spectra of Xe-n(+) clusters
    CHEMICAL PHYSICS 311 (3): 287-297, 2005.
    Abstract


    KALUS R., HRIVŇÁK D.
    Modelling of Kr-n(+) clusters. III. Photoabsorption spectra n of medium-size clusters (n=6-20)
    CHEMICAL PHYSICS 303 (3): 279-290, 2004.
    Abstract


    KALUS R., PAIDAROVÁ I., HRIVŇÁK D., ET AL.
    Modelling of Kr-n(+) clusters. II. Photoabsorption spectra of small clusters (n=2-5)
    CHEMICAL PHYSICS 298 (1-3): 155-166, 2004.
    Abstract


    JANEČEK I., VAŠEK P.
    Transverse voltages and reciprocity theorem in magnetic fields for high T-c superconductors
    PHYSICA C-SUPERCONDUCTIVITY AND ITS APPLICATIONS 402 (1-2): 199-208, 2004.
    Abstrakt


    KALUS R., PAIDAROVÁ I., HRIVŇÁK D., ET AL.
    Modelling of Kr-n(+) clusters (n=2-20). I. Structures and energetics
    CHEMICAL PHYSICS 294 (2): 141-153, 2003.
    Abstract


    PAŠKA P., HRIVŇÁK D., KALUS R.
    Diatomics-in-molecules study of the geometric and electronic structure of Xe-n(+) clusters
    CHEMICAL PHYSICS 286 (2-3): 237-248, 2003.
    Abstract


    SLAVÍČEK P., KALUS R., PAŠKA P., ET AL.
    State-of-the-art correlated ab initio potential energy curves for heavy rare gas dimers: Ar-2, Kr-2, and Xe-2
    JOURNAL OF CHEMICAL PHYSICS 119 (4): 2102-2119, 2003.
    Abstrakt


    JANEČEK I., VAŠEK P.
    Reciprocity theorem in high-temperature superconductors
    PHYSICA C-SUPERCONDUCTIVITY AND ITS APPLICATIONS 390 (4): 330-340, 2003.
    Abstrakt


    JANEČEK I., VAŠEK P.
    Mixed state Hall effect in the multiphase superconductors
    PHYSICA C-SUPERCONDUCTIVITY AND ITS APPLICATIONS 384 (3): 351-355, 2003.
    Abstrakt


    GALINDEZ J., CALVO F., PAŠKA P., ET AL.
    DIM modelings for realistic simulations of ionic rare-gas clusters, test on structures and photoabsorption spectra of Ar-n(+) (n=3-8)
    COMPUTER PHYSICS COMMUNICATIONS 145 (1): 126-140 2002.
    Abstract


    KALUS R., HRIVŇÁK D.
    Theoretical calculations on the structure and photoabsorption of Xe-n(+) cations (n = 3, 4, 19)
    CHEMICAL PHYSICS 278 (1): 21-29, 2002.
    Abstrakt


    HRIVŇÁK D., KALUS R.
    Intra-cluster transitions in small Ar-n(+) cations
    CHEMICAL PHYSICS 264 (3): 319-331, 2001.
    Abstrakt


    KALUS R.
    Kinetics of collision processes in dilute noble gases
    COLLECTION OF CZECHOSLOVAK CHEMICAL COMMUNICATIONS 65 (2): 141-160, 2000.
    Abstrakt


    KALUS R.
    Collisions of noble gas dimers with monomers: A classical trajectory study
    JOURNAL OF CHEMICAL PHYSICS 110 (8): 3856-3860, 1999.
    Abstrakt


    VAŠEK P., JANEČEK, I.
    Transport and magnetic properties of Bi based multiphase superconductors
    INTERNATIONAL JOURNAL OF MODERN PHYSICS B 13 (29-31): 3741-3743, 1999.
    Abstrakt


    KALUS R.
    Formation of argon dimers in ternary monomer collisions - A classical trajectory study
    JOURNAL OF CHEMICAL PHYSICS 109 (19): 8289-8294, 1998.
    Abstrakt


    VAŠEK P., JANEČEK I., PLECHÁČEK V.
    Activation energies for depinning of vortices from intrinsic and extrinsic pinning centers in high T-c superconductors
    PHYSICA C 282: 2373-2374 , 1997.
    Abstrakt


    VAŠEK P., JANEČEK I., PLECHÁČEK V.
    Intrinsic pinning and guided motion of vortices in high-t-c superconductors
    PHYSICA C 247 (3-4): 381-384, 1995.
    Abstrakt


    VAŠEK P., JANEČEK I., PLECHÁČEK V.
    Anisotropy of the hall effect in the mixed state
    PHYSICA C 235-240 (5): 3145-3146, 1994.
    Abstrakt


    E. POLLERT, D. SEDMIDUBSKÝ, K. KNÍŽEK, Z. JIRÁK, P. VAŠEK AND I. JANEČEK
    Structural and transport properties of yba2cu3-ycoyo7-x solid solutions
    PHYSICA C 197 ( 3-4): 1992, 371-377, 1992.
    Abstrakt


    VAŠEK P., JANEČEK I., PLECHÁČEK V.
    The hall-effect anomaly in single-phase bi based ceramics
    SOLID STATE COMMUNICATIONS 79 (9): 717-721, 1991.
    Abstrakt




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    conferences

    VÍTEK A., LIČMANOVÁ L., PAIDAROVÁ I., KALUS R.
    Phase chnges in molecular clusters
    62ND MEETING OF THE ASSOCIATION OF CZECH AND SLOVAK CHEMICAL SOCIETIES

    Pardubice, 28. - 30. 6. 2010


    LIČMANOVÁ, L.; VÍTEK, A.; PAIDAROVÁ, I.; KALUS, R.
    DFT and empirical models of interactions in Monte Carlo simulations of water clusters.
    62ND MEETING OF THE ASSOCIATION OF CZECH AND SLOVAK CHEMICAL SOCIETIES

    Pardubice, 28. - 30. 6. 2010


    SVRČKOVÁ, P.; VÍTEK, A.; KALUS, R.
    Ionization potentials of rare-gas clusters
    62ND MEETING OF THE ASSOCIATION OF CZECH AND SLOVAK CHEMICAL SOCIETES

    Pardubice, 28. - 30. 6. 2010


    KARLICKÝ, F.
    Ionized helium clusters: zero-temperature quantum effects
    QMC AND THE CASINO PROGRAM V

    Vallico Sotto, Tuscany, Italy, 1. - 8. 8. 2010
    Web


    VÍTEK, A., PAIDAROVÁ, I., KALUS, R.
    Structural changes in the water tetramer and hexamer. A combined Monte Carlo and DFT study.

    12. 9. - 15. 9. 2010, Nový Smokovec, Slovensko.


    MALOHLAVA, J., VÍTEK, A., KALUS, R.
    Protonated water clusters - structures and thermodynamics.

    12. - 15. 9. 2010, Nový Smokovec.


    KARLICKÝ, F., ZBOŘIL, R., OTYEPKA, M.
    Band-gap engineering of graphene derivates
    NANOCON 2011

    Olomouc, Czech Republic, 12. - 14. 10. 2010
    Conference web


    OLEKSY, K.; HRIVŇÁK, D.; KARLICKÝ, F.; KALUS, R.
    Stability of Singly Ionized Helium and Argon Clusters
    SYMPOSIUM ON SIZE SELECTED CLUSTERS S3C

    Brand, AT – Rakouská republika, 8. 3. 2009 – 13. 3. 2009.
    Conference web


    VÍTEK, A.; PAIDAROVÁ, I.; KALUS, R.; LIČMANOVÁ, L.
    Thermodynamics of water clusters calculated ab initio.
    CENTRAL EUROPEAN SYMPOSIUM ON THEORETICAL CHEMISTRY

    Dobogókö, Maďarsko, 25. 9. - 28. 9. 2009
    Conference web


    KARLICKÝ, F.; LEPETIT, B.; PAIDAROVÁ, I.; OLEKSY, K.; ZÁRUBOVÁ, L.; JOSIEK, J.; KALUS, R.
    Ionized helium clusters: quantum effects.
    CENTRAL EUROPEAN SYMPOSIUM ON THEORETICAL CHEMISTRY

    Dobogókö, Maďarsko, 25. 9. - 28. 9. 2009
    Conference web


    OLEKSY, K.
    Global optimization of molecular structures
    LIQUID MATTER WORKSHOP 2009

    Tábor, Česká republika, 22.10. – 24.10. 2009


    JANEČEK, I.; CINTAVÁ, S.; KALUS, R.; HRIVŇÁK, D.; GADÉA, F.
    Molecular dynamics with stochastic decoherence applied to rare-gas clusters
    CENTRAL EUROPEAN SYMPOSIUM ON THEORETICAL CHEMISTRY

    Hejnice, Czech Republic 28.9.-1.10.2008


    OLEKSY, K.; HRIVŇÁK, D.; KALUS, R.
    Equilibrium structures of HeN+ clusters through the genetic algorithm approach
    CENTRAL EUROPEAN SYMPOSIUM ON THEORETICAL CHEMISTRY 2008

    Hejnice, Czech Republic, 28 September – 1 October, 2008
    Conference web


    KALUS, R.; PAIDAROVA, I.; SVRCKOVA, P. ET AL.
    Ionization potentials of rare-gas clusters.
    CENTRAL EUROPEAN SYMPOSIUM ON THEORETICAL CHEMISTRY 2008,

    Hejnice, Czech Republic, 28 September – 1 October, 2008
    Conference web


    OLEKSY, K.; HRIVŇÁK, D.; KALUS, R.
    Equilibrium structures of Arn+ clusters through the genetic algorithm approach.
    CENTRAL EUROPEAN SYMPOSIUM ON THEORETICAL CHEMISTRY

    Litschau, AT - Rakouská republika, 23. 9. 2007 - 26. 9. 2007.


    KARLICKÝ, F.; LEPETIT, B.; KALUS, R.; GADÉA, F.
    Rovibrational spectrum of argon trimer.
    SYMPOSIUM ON ADVANCED METHODS OF QUANTUM CHEMISTRY AND PHYSICS

    Torun, PL - Polská republika, 2. 9. 2007 - 6. 9. 2007.


    LEPETIT, B.; KARLICKÝ, F.; KALUS, R.; GADÉA, F.
    Calculation of argon trimer rovibrational spectrum.
    COMET XX - 20TH INTERNATIO