Browsing by Author KOVACS ATTILA

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Publication YearJRC N°TitleAuthor(s), Editor(s), Other Contributor(s)Publication Type
2014JRC91961Az f-elemek elektronszerkezetePOGANY Peter; KOVACS ATTILAArticles in periodicals and books
2017JRC100261Benchmarking density functionals in conjunction with Grimme’s dispersion correction for noble gas dimers (Ne2, Ar2, Kr2, Xe2, Rn2)KOVACS ATTILA; DOBROWOLSKI JAN; OSTROWSKI SLAWOMIR; RODE JOANNAArticles in periodicals and books
2019JRC115161Comparative study of complexes of rare earths and actinides with 2,6-bis(1,2,4-triazin-3-yl)pyridineKOVACS ATTILA; APOSTOLIDIS CHRISTOS; WALTER OLAFArticles in periodicals and books
2011JRC64469Computed vibrational frequencies of actinide oxides AnO0/+/2+ and AnO20/+/2+ (An = Th, Pa, U, Np, Pu, Am, Cm)KOVACS ATTILA; KONINGS RudyArticles in periodicals and books
2018JRC111860Coordination of N2 ligands to lanthanum: the complexes La (N2)1–8KOVACS ATTILAArticles in periodicals and books
2014JRC89491A DFT Investigation of the Interactions of Pd, Ag, Sn and Cs with silicon carbideRABONE JEREMY; KOVACS ATTILAArticles in periodicals and books
2017JRC102376Electronic structure and spectroscopic properties of mixed sodium actinide oxides Na2AnO4 (An = U, Np, Pu, Am)KOVACS ATTILAArticles in periodicals and books
2017JRC107735Electronic structure of mixed caesium actinide oxides Cs2AnO4 (An = U, Np, Pu, Am)KOVACS ATTILAArticles in periodicals and books
2011JRC65771How accurate are electronic structure methods for actinoid chemistry?AVERKIEV Boris; MANTINA Manjeera; VALERO Rosendo; INFANTE Ivan; KOVACS ATTILA; TRUHLAR Donald G.; GAGLIARDI LArticles in periodicals and books
2013JRC79777Interaction of advanced oxide fuels with sodium in operating conditions for Sodium-cooled Fast ReactorsSMITH ANNA; BYKOV DENIS; RAISON Philippe; KONINGS Rudy; COLLE Jean-Yves; WALLEZ G; BENES ONDREJ; APOSTOLIDIS Christos; KOVACS ATTILA; SUARD E., et alArticles in periodicals and books
2014JRC92285Joint Raman spectroscopic and quantum chemical analysis of the vibrational features of Cs2RuO4NAJI MOHAMED; DI LEMMA FIDELMA; KOVACS ATTILA; BENES ONDREJ; MANARA Dario; COLLE Jean-Yves; PAGLIOSA Giorgio; RAISON Philippe; KONINGS RudyArticles in periodicals and books
2015JRC96350'Lanthanide contraction' in [Ln(BTP)3](CF3SO3)3 complexesKOVACS ATTILA; APOSTOLIDIS Christos; WALTER OLAF; LINDQVIST-REIS PatricArticles in periodicals and books
2013JRC75616Mass spectrometric study of the vaporization behaviour of a-Na2NpO4: Thermodynamic investigation of the enthalpy of formationSMITH ANNA; COLLE Jean-Yves; BENES ONDREJ; KOVACS ATTILA; RAISON Philippe; KONINGS RudyArticles in periodicals and books
2010JRC59746Matrix-isolation FT-IR study of (CsBr)n and (CsI)n (n = 1-3)GROEN Cornelius Petrus; KOVACS ATTILAArticles in periodicals and books
2017JRC103651Modelling the matrix shift on the vibrational frequency of ThO by DFT-D3 calculationsKOVACS ATTILA; RODE JoannaArticles in periodicals and books
2016JRC100818Molecular data of mixed metal oxides with importance in nuclear safetyKOVACS ATTILA; KONINGS RudyArticles in periodicals and books
2012JRC67218Molecular Structure and Vibrational Spectra of Mixed MDyX4 (M=Li, Na, K, Rb, Cs; X=F, Cl, Br, I) Vapor Complexes - A Computational and Matrix-Isolation Infrared Spectroscopic StudyGROEN Cornelius Petrus; KOVACS ATTILA; VARGA Z.; HARGITTAI MagdonlaArticles in periodicals and books
2018JRC112062Pentavalent Curium, Berkelium, and Californium in Nitrate Complexes: Extending Actinide Chemistry and Oxidation StatesKOVACS ATTILA; DAU PHUONG D.; MARCALO JOAQUIM; GIBSON JOHN K.Articles in periodicals and books
2015JRC89293Quantum chemical calculations and experimental investigations of molecular actinide oxidesKOVACS ATTILA; KONINGS Rudy; GIBSON John K.; INFANTE Ivan; GAGLIARDI LauraArticles in periodicals and books
2017JRC105662Relativistic multireference quantum chemical study of the electronic structure of actinide trioxide moleculesKOVACS ATTILAArticles in periodicals and books