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Title Synthesis, crystal structure, spectral characterization, and theoretical study of glycolato peroxido complexes of vanadium(V) Author Orešková Gabriela Co-authors Chrappová Jana Puškelová Jarmila Šimunek Ján Schwendt Peter Noga Jozef 1955 SAVANOCH - Ústav anorganickej chémie SAV Gyepes Róbert Source document Structural Chemistry. Vol. 27, no. 2 (2016), p. 605-615 Category ADCA - Scientific papers in foreign journals registered in Current Contents Connect with IF (impacted) Category of document (from 2022) V3 - Vedecký výstup publikačnej činnosti z časopisu Type of document článok Year 2016 DOI 10.1007/s11224-015-0593-9 File name Access Size Downloaded Type License Synthesis, crystal structure, spectral characterization, and theoretical study of glycolato peroxido complexes of vanadium(V).pdf Neprístupný/archív 745.2 KB 1 Publisher's version 
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Title Explicitly correlated MP2 method based on optimized Thouless expansion Author Kedžuch Stanislav 1979 SAVANOCH - Ústav anorganickej chémie SAV Co-authors Šimunek Ján Noga Jozef 1955 SAVANOCH - Ústav anorganickej chémie SAV Source document JCS - 2015. 6th JCS international symposium on theoretical chemistry, Smolenice castle, Smolenice, october 11th - 15th, 2015. P. 71. - Bratislava, Slovakia : Institute of Inorganic Chemistry, Slovak Academy of Sciences, 2015 ; JCS - 2015 Category AFH - Abstracts of papers from domestic conferences Year 2015 article
Title Structural and spectral properties of tartrato complexes of vanadium(V) from quantum chemical calculations Author Orešková Gabriela Co-authors Krivosudský Lukáš Šimunek Ján Noga Jozef 1955 SAVANOCH - Ústav anorganickej chémie SAV Source document Theoretical Chemistry Accounts. Vol. 134, no. 10 (2015), 116-1-116-10 Category ADCA - Scientific papers in foreign journals registered in Current Contents Connect with IF (impacted) Category of document (from 2022) V3 - Vedecký výstup publikačnej činnosti z časopisu Type of document článok Year 2015 DOI 10.1007/s00214-015-1719-2 article
Title Optimised Thouless expansion second-order Møller-Plesset theory Author Šimunek Ján Co-authors Noga Jozef 1955 SAVANOCH - Ústav anorganickej chémie SAV Source document Molecular Physics. Vol. 111, no. 9-11 (2013), p. 1119-1128 Category ADCA - Scientific papers in foreign journals registered in Current Contents Connect with IF (impacted) Category of document (from 2022) V3 - Vedecký výstup publikačnej činnosti z časopisu Type of document článok Year 2013 DOI 10.1080/00268976.2013.799720 article
Title Brueckner coupled cluster calculations based on optimized Thouless expansion Author Šimunek Ján Co-authors Noga Jozef 1955 SAVANOCH - Ústav anorganickej chémie SAV Source document CESTC 2013. Central European symposium on theoretical chemistry, Znojmo, Czech Republic, 22-25 september 2013. P. 77. - Prague, Czech Republic : J. Heyrovsky Institute of Physical Chemistry, v.v.i., 2013 / Tarana Michal ; Čurík Roman ; CESTC 2013 Category AFG - Abstracts of papers from foreign conferences Year 2013 article
Title Dvojjadrové a štvorjadrové tartarátokomplexy vanádu(V): Kvantovo-chemické výpočty štruktúrnych a spektroskopických parametrov Title translation Binuclear and tetranuclear tartrato complexes of vanadium(V): quantum chemical calculations of the structural and spectral properties Author Orešková Gabriela Co-authors Šimunek Ján Noga Jozef 1955 SAVANOCH - Ústav anorganickej chémie SAV Source document Pokroky v anorganickej chémii, 18.-21. júna 2012 : zborník príspevkov z ix. seminára. S. 80-81. - Bratislava : Univerzita Komenského v Bratislave, 2012 ; Pokroky v anorganickej chémii Category AFDB - Published papers from domestic scientific conferences Year 2012 article
Title Hartree-Fock via variational coupled cluster theory: an alternative way to diagonalization free algorithm Author Šimunek Ján Co-authors Noga Jozef 1955 SAVANOCH - Ústav anorganickej chémie SAV Source document AIP Conference Proceedings. Vol. 1504 (2012), p. 143-151 Category ADMB - Scientific papers in foreign non-impacted journals registered in Web of Sciences or Scopus Category of document (from 2022) V3 - Vedecký výstup publikačnej činnosti z časopisu Type of document článok Year 2012 DOI 10.1063/1.4771709 article
Title Acceleration of self-consistent-field convergence by combining conventional diagonalization and a diagonalization-free procedure Author Baldes Alexander Co-authors Klopper Wim Šimunek Ján Noga Jozef 1955 SAVANOCH - Ústav anorganickej chémie SAV Weigend Florian Source document Journal of Computational Chemistry. Vol. 32, no. 14 (2011), p. 3129-3134 Category ADCA - Scientific papers in foreign journals registered in Current Contents Connect with IF (impacted) Category of document (from 2022) V3 - Vedecký výstup publikačnej činnosti z časopisu Type of document článok Year 2011 DOI 10.1002/jcc.21877 article
Title Solving the independent-particle model via nonunitary transformation based on variational coupled cluster singles Author Noga Jozef 1955 SAVANOCH - Ústav anorganickej chémie SAV Co-authors Šimunek Ján Source document Journal of Chemical Theory and Computation. Vol. 6, no. 9 (2010), p. 2706-2713 Category ADCA - Scientific papers in foreign journals registered in Current Contents Connect with IF (impacted) Category of document (from 2022) V3 - Vedecký výstup publikačnej činnosti z časopisu Type of document článok Year 2010 DOI 10.1021/ct1003143 article
Title Proton affinity and enthalpy of formation of formaldehyde Author Czakó Gábor Co-authors Nagy Balazs Tasi Gyula Somogyi Arpad Šimunek Ján Noga Jozef 1955 SAVANOCH - Ústav anorganickej chémie SAV Braams Bastiaan J. Bowman Joel M. Császár Attila G. Source document International Journal of Quantum Chemistry. Vol. 109, no. 11 (2009), p. 2393-2409 Category ADCA - Scientific papers in foreign journals registered in Current Contents Connect with IF (impacted) Category of document (from 2022) V3 - Vedecký výstup publikačnej činnosti z časopisu Type of document článok Year 2009 DOI 10.1002/qua.22009 article