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Title Approximated MP2 for extended systems with helical symmetry Author info Matej Veis, Miroslva Melicherčík, Jozef Noga Author Veis Matej (40%)
Co-authors Melicherčík Miroslav 1984- (20%) UMBFP05 - Katedra informatiky
Noga Jozef (20%)
Source document 16th International congress of quantum chemistry. P. [1]. - Menton : [s. n.], 2018 ; The international congress of quantum chemistry medzinárodný kongres Keywords MP2 metóda špirálová symetria - helical symmetry Form. Descr. abstrakty - abstracts Language English Country France Public work category BFA No. of Archival Copy 47551 Catal.org. BB301 - Univerzitná knižnica Univerzity Mateja Bela v Banskej Bystrici Database xpca - PUBLIKAČNÁ ČINNOSŤ Title Základy numerickej matematiky pre prírodovedcov Subtitle s príkladmi v Microsoft Excel Author info Ivan Černušák ... [et al.]; rec. Andrej Antušek, Vladimír Janiš Author Černušák Ivan (20%)
Co-authors Neogrády Pavel (20%)
Noga Jozef (20%)
Iliaš Miroslav 1975- (20%) UMBEF - Ekonomická fakulta
Pitoňák Michal (20%)
Another authors Antušek Andrej (Recenzent)
Janiš Vladimír 1963- (Recenzent)
Issue data Banská Bystrica : Fakulta prírodných vied Univerzity Mateja Bela , 2012. - 118 s. Issue 2. vyd. ISBN 978-80-557-0277-3 Keywords numerická matematika - numerical mathematics prírodovedci - naturalists vysokoškolské učebnice - učebnice vysokých škôl university textbooks Language Slovak Country Slovak Republic systematics 519.6 168.521 Public work category ACB No. of Archival Copy 22551 Catal.org. BB301 - Univerzitná knižnica Univerzity Mateja Bela v Banskej Bystrici Database xpca - PUBLIKAČNÁ ČINNOSŤ Title Applicability of graphical processing units to coupled clusters calculations Par.title Aplikovateľnosť grafických kariet na výpočty spriahnutých klastrov Author info Miroslav Melicherčík ... [et al.] Author Melicherčík Miroslav 1984- (25%)
Co-authors Demovič Lukáš (25%)
Pitoňák Michal (25%)
Neogrády Pavel (25%)
Source document The 9th Central European Symposium on Theoretical Chemistry : book of abstracts : Nový Smokovec, September 12 - 15, 2010. S. 97-98. - Bratislava : Univerzita Komenského, 2010 / Noga Jozef ; Melicherčík Miroslav 1984- ; Černušák Ivan Keywords klastre - clusters grafické karty graphic cards Language English Country Slovak Republic systematics 004.3 Public work category AFH No. of Archival Copy 29865 Repercussion category DEPRINCE, A. Eugene - HAMMOND, Jeff R. Coupled cluster theory on graphics processing Units I. The coupled cluster doubles method. In Journal of chemical theory and computation. ISSN 1549-9618, 2011, vol. 7, no. 5, pp. 1287-1295.
Catal.org. BB301 - Univerzitná knižnica Univerzity Mateja Bela v Banskej Bystrici Database xpca - PUBLIKAČNÁ ČINNOSŤ Title The 9th Central European Symposium on Theoretical Chemistry Subtitle book of abstracts Nový Smokovec, September 12 - 15, 2010 Author info ed. Jozef Noga, Miroslav Melicherčík, Ivan Černušák Another authors Noga Jozef (Licensor)
Melicherčík Miroslav 1984- (Licensor)
Černušák Ivan (Licensor)
Issue data Bratislava : Univerzita Komenského , 2010 Issue 1. vyd. ISBN 978-80-223-2907-1 Language English Country Slovak Republic Public work category FAI Catal.org. BB301 - Univerzitná knižnica Univerzity Mateja Bela v Banskej Bystrici Database xpca - PUBLIKAČNÁ ČINNOSŤ References (2) - PUBLIKAČNÁ ČINNOSŤ Title Weak interactions between air pollutants Author info Šimon Budzák, Ivan Černušák, Miroslav Medveď Author Budzák Šimon 1982- (34%) UMBFP08 - Katedra chémie
Co-authors Černušák Ivan (33%)
Medveď Miroslav 1971- (33%) UMBFP08 - Katedra chémie
Source document The 9th Central European Symposium on Theoretical Chemistry : book of abstracts : Nový Smokovec, September 12 - 15, 2010. S. 67-68. - Bratislava : Univerzita Komenského, 2010 / Noga Jozef ; Melicherčík Miroslav 1984- ; Černušák Ivan Keywords CO NO H2O slabé interakcie weak interactions Language English Country Slovak Republic systematics 54 Public work category AFL No. of Archival Copy 16889 Catal.org. BB301 - Univerzitná knižnica Univerzity Mateja Bela v Banskej Bystrici Database xpca - PUBLIKAČNÁ ČINNOSŤ Title NLO responses of small polymethineimine oligomers: A CCSD(T) study Par.title NLO odozvy malých polymetylénimínových oligomérov: CCSD(T) štúdia Author info Miroslav Medveď ... [et al.] Co-authors Medveď Miroslav 1971- (30%%) UMBFP08 - Katedra chémie
Another authors Noga Jozef (Author) (30%%)
Jacquemin Denis (Author) (20%%)
Assfeld Xavier (Author) (10%%)
Perpéte Eric A. (Author) (10%%)
Source document Journal of Molecular Structure : THEOCHEM. Vol. 821, no. 1-3 (2007), pp. 160-165. - Amsterdam : Elsevier B.V., 2007 Keywords NLO vlastnosti - NLO properties polymetylénimín hyperpolarizovateľnosť CCSD(T) metóda NLO properties hyperpolarizability polymethineimine Language English Country Netherlands systematics 54 Public work category ADC No. of Archival Copy 6791 Repercussion category KRAWCZYK, Przemyslaw. DFT study of linear and nonlinear optical properties of donor-acceptor substituted stilbenes, azobenzenes and benzilideneanilines. In Journal of molecular modeling. ISSN 1610-2940, 2010, vol. 16, no. 4, pp. 659-668.
HERNANDEZ-PAREDES, J. - GLOSSMAN-MITNIK, Daniel - DUARTE-MOLLER, A. - FLORES-HOLGUIN, N. Theoretical calculations of molecular dipole moment, polarizability, and first hyperpolarizability of glycine-sodium nitrate. In Journal of molecular structure-Theochem. ISSN 0166-1280, 2009, vol. 905, no. 1-3, pp. 76-80.
AMALANATHAN, M. - XAVIER, T.S. - JOE, I. Hubert - RASTOGI, V.K. Normal coordinate analysis and nonlinear optical response of cross-conjugated system 4,4-dimethyl benzophenone. In Spectrochimica acta part A : molecular and biomolecular spectroscopy. ISSN 1386-1425, 2013, vol. 116, pp. 574-583.
BULIK, Ireneusz W. - ZALESNY, Robert - BARTKOWIAK, Wojciech et al. Performance of density functional theory in computing nonresonant vibrational (hyper)polarizabilities. In Journal of computational chemistry. ISSN 0192-8651, 2013, vol. 34, no. 20, pp. 1775-1784.
Catal.org. BB301 - Univerzitná knižnica Univerzity Mateja Bela v Banskej Bystrici Database xpca - PUBLIKAČNÁ ČINNOSŤ References PERIODIKÁ-Súborný záznam periodika Title Electric properties of cyanoborane isomers Author info Miroslav Medveď ...[et al.] Author Medveď Miroslav 1971- (25%) UMBFP08 - Katedra chémie
Co-authors Černušák Ivan (25%)
Another authors Kedžuch Stanislav (Author) (25%)
Noga Jozef (Author) (25%)
Source document Collection of Czechoslovak Chemical Communications. Vol. 70, no. 8 (2005), pp. 1055-1081. - Prague : The Czech Academy of Sciences, 2005 Keywords cyanoborane isomers electric properties Language English Country Czech Republic systematics 54 Public work category ADC No. of Archival Copy 1480 Catal.org. BB301 - Univerzitná knižnica Univerzity Mateja Bela v Banskej Bystrici Database xpca - PUBLIKAČNÁ ČINNOSŤ References PERIODIKÁ-Súborný záznam periodika Title Longitudinal NLO Properties of C2H2, HCCF, and C2F2: Electron Correlation and Vibration Effects Author info Miroslav Medveď...[et al.] Author Medveď Miroslav 1971- UMBFP08 - Katedra chémie
Another authors Noga Jozef (Author)
Jacquemin Denis (Author)
Perpéte Eric A. (Author)
Source document International Journal of Quantum Chemistry. Vol. 102, no. 2 (2005), pp. 209-223. - Hoboken : Wiley-Blackwell, 2005 Keywords chémia - chemistry elektrónová korelácia optika - optics nonlinear optical properties nuclear relaxation effects Language English Country United States of America systematics 54 Public work category ADC No. of Archival Copy 1478 Repercussion category KIRTMAN, Bernard - LUIS, Josep M. Simple finite field nuclear relaxation method for calculating vibrational contribution to degenerate four-wave mixing. In Journal of chemical physics. ISSN 0021-9606, 2008, vol. 128, no. 11.
AVRAMOPOULOS, Aggelos - SERRANO-ANDRES, Luis - LI, Jiabo - REIS, Heribert - PAPADOPOULOS, Manthos G. Linear and nonlinear optical properties of some organoxenon derivatives. In Journal of chemical physics. ISSN 0021-9606, 2007, vol. 127, no. 21.
LUIS, Josep M. - TORRENT-SUCARRAT, Miquel - CHRISTIANSEN, Ove - KIRTMAN, Bernard. Variational calculation of static and dynamic vibrational nonlinear optical properties. In Journal of chemical physics. ISSN 0021-9606, 2007, vol. 127, no. 8.
ALABUGIN, Igor V. - MANOHARAN, Mariappan. Rehybridization as a general mechanism for maximizing chemical and supramolecular bonding and a driving force for chemical reactions. In Journal of computational chemistry. ISSN 0192-8651, 2007, vol. 28, no. 1, pp. 373-390.
MARAVAL, Valerie - CHAUVIN, Remi. Carbo-mers: From skeleton to function. In New journal of chemistry. ISSN 1144-0546, 2007, vol. 31, no. 11, pp. 1853-1873.
PUGH, David - HINCHLIFFE, A. Polarizabilities, Hyperpolarizabilities and Analogous Magnetic Properties. In Chemical Modelling Applications and Theory. Cambridge : Royal Soc Chemistry, 2006. Vol. 4. ISBN 978-1-84755-526-7, pp. 69-107.
ZALESNY, Robert - GORA, Robert W. - LUIS, Josep M. - BARTKOWIAK, Wojciech. On the particular importance of vibrational contributions to the static electrical properties of model linear molecules under spatial confinement. In Physical chemistry - Chemical physics. ISSN 1463-9076, 2015, vol. 17, no. 34, pp. 21782-21786.
Catal.org. BB301 - Univerzitná knižnica Univerzity Mateja Bela v Banskej Bystrici Database xpca - PUBLIKAČNÁ ČINNOSŤ References PERIODIKÁ-Súborný záznam periodika Title Electronic NLO properties of cyanoborane monomers Author info Miroslav Medveď... [et al.] Co-authors Medveď Miroslav 1971- UMBFP08 - Katedra chémie
Another authors Černušák Ivan (Author)
Kedžuch Stanislav (Author)
Noga Jozef (Author)
Source document Modelling and Design of Molecular Materials : program book of abstracts : workshop Wroclaw, Poland September 16-20, 2004. S. [1 s.]. -, 2004 Keywords NLO properties NLO vlastnosti - NLO properties Language English Country Poland systematics 54 Public work category AFK No. of Archival Copy 3612 Catal.org. BB301 - Univerzitná knižnica Univerzity Mateja Bela v Banskej Bystrici Database xpca - PUBLIKAČNÁ ČINNOSŤ Title Dipole polarizability and second hyperpolarizability of difluoroacetylene Subtitle basis set dependence and electron correlation effects Author info Miroslav Medveď ... [et al.] Author Medveď Miroslav 1971- UMBFP08 - Katedra chémie
Co-authors Champagne Benoit
Another authors Noga Jozef (Author)
Perpéte Eric A. (Author)
Source document Journal of Computational Methods in Sciences and Engineering. Vol. 10 ,(4) (2004), s. 251-265 Keywords elektrónová korelácia nukleárna relaxácia palarizability coupled cluster method approximation Language English Country United States of America systematics 54 Public work category ADE No. of Archival Copy 1479 Catal.org. BB301 - Univerzitná knižnica Univerzity Mateja Bela v Banskej Bystrici Database xpca - PUBLIKAČNÁ ČINNOSŤ