Pregled po CROSBI profilu: Mirjana Maksić (CROSBI Profil: 18698, MBZ: 27544)

1.

Glasovac, Zoran; Eckert-Maksić, Mirjana; Kaljurand, Ivari; Saame, Jaan; Leito, Ivo

Gas phase basicity of biguanides – Comparison of the equilibrium and the kinetic methods // International journal of mass spectrometry, 435 (2019), 61-68 doi:10.1016/j.ijms.2018.10.010 (međunarodna recenzija, članak, znanstveni)

doi www.sciencedirect.com

2.

Ayoub, Ghada; Štrukil, Vjekoslav; Fábián, László; Mottillo, Cristina; Bao, Huizhi; Murata, Yasujiro; Moores, Audrey; Margetić, Davor; Eckert-Maksić, Mirjana; Friščić, Tomislav

Mechanochemistry vs. solution growth: striking differences in bench stability of a cimetidine salt based on a synthetic method // Crystengcomm, 20 (2018), 7242-7247 doi:10.1039/C8CE01727A (međunarodna recenzija, članak, znanstveni)

doi pubs.rsc.org

3.

Antol, Ivana; Eckert-Maksić, Mirjana

The influence of multiple fluorination on the ring opening of [2.2.2]propellane // Croatica chemica acta, 90 (2017), 2; 215-223 doi:10.5562/cca3172 (međunarodna recenzija, članak, znanstveni)

doi

4.

Vazdar, Mario; Eckert-Maksić, Mirjana; Lischka, Hans

The antiferromagnetic spin coupling in non- Kekulé Acenes–impressive poly-radical character revealed by high level multi-reference methods // ChemPhysChem, 17 (2016), 13; 2013-2021 doi:10.1002/cphc.201600103 (međunarodna recenzija, članak, znanstveni)

doi onlinelibrary.wiley.com onlinelibrary.wiley.com

5.

Vazdar, Mario; Eckert-Maksić, Mirjana

Multireference Configuration Interaction Methods : An Application to the Valence Isomerism in Cyclobutadieno-p-benzoquinone and its Diprotonated Form // Croatica chemica acta, 88 (2015), 4; 495-503 doi:10.5562/cca2770 (međunarodna recenzija, članak, znanstveni)

doi

6.

Racar, Marko; Šoljić Jerbić, Ivana; Glasovac, Zoran; Eckert Maksić, Mirjana; Kauzlarić, Zrinka; Platiša, Olivera; Jukić, Ante

The activity of new guanidine catalysts and optimization of biodiesel production process using response surface methodology // 47th International Symposium FUELS 2014 Book of Abstracts / Jukić, Ante (ur.).
Zagreb: Croatian Society for Fuels and Lubricants, 2014. str. 16-16 (predavanje, međunarodna recenzija, sažetak, znanstveni)

7.

Štrukil, Vjekoslav; Lekšić, Edislav; Meštrović, Ernest; Eckert-Maksić, Mirjana

The synthesis and structural characterization of peralkylated triguanide superbases // Australian journal of chemistry, 67 (2014), 7; 1129-1133 doi:10.1071/CH14233 (međunarodna recenzija, članak, znanstveni)

doi www.publish.csiro.au www.publish.csiro.au dx.doi.org

8.

Glasovac, Zoran; Eckert-Maksić, Mirjana

Effect of Intramolecular Hydrogen Bonds on the Gas-phase Basicity of Guanidines // Australian journal of chemistry, 67 (2014), 7; 1056-1062 doi:10.1071/CH14182 (međunarodna recenzija, članak, znanstveni)

doi www.publish.csiro.au dx.doi.org www.publish.csiro.au

9.

Eckert-Maksić, Mirjana; Antol, Ivana; Vazdar, Mario

Acetamide as the Model of the Peptide Bond: Nonadiabatic Photodynamical Simulations in the Gas Phase and in the Argon Matrix // Computational and theoretical chemistry, 1040/1041 (2014), 136-143 doi:10.1016/j.comptc.2014.02.025 (međunarodna recenzija, članak, znanstveni)

doi www.sciencedirect.com

10.

Eckert-Maksić, Mirjana

Search for strong guanidine bases. Theory and experiment in concert // The 14th European Symposium on Organic Reactivity- Book of abstracts / Michl, Josef ; Roithová, Jana (ur.).
Prag: Institute of Chemical Technology & Institute of Organic Chemistry and Biochemistry, 2013. (pozvano predavanje, međunarodna recenzija, sažetak, znanstveni)

11.

Eckert-Maksić, Mirjana; Antol, Ivana; Vazdar, Mario

Computational study of acetamide photodissociation // 18th European Symposium on Organic Chemistry / Rodriguez, Jean-Antoine (ur.).
Marseille: Aix Marseille University, 2013. (poster, međunarodna recenzija, sažetak, znanstveni)

12.

Glasovac, Zoran; Trošelj, Pavle; Jušinski, Iva; Margetić, Davor; Eckert-Maksić, Mirjana

Synthesis of highly basic hexasubstituted biguanides by environmentally friendly methods // Synlett, 24 (2013), 19; 2540-2544 doi:10.1055/s-0033-1339876 (međunarodna recenzija, članak, znanstveni)

doi www.thieme-connect.com

13.

Glasovac, Zoran; Pavošević, Fabijan; Štrukil, Vjekoslav; Eckert-Maksić, Mirjana; Schlangen, Maria; Kretschmer, Robert

Toward Extension of the Gas-Phase Basicity Scale by Novel Pyridine Containing Guanidines // International journal of mass spectrometry, 354/355 (2013), 113-122 doi:10.1016/j.ijms.2013.06.012 (međunarodna recenzija, članak, znanstveni)

doi www.sciencedirect.com dx.doi.org

14.

Glasovac, Zoran; Racar, Marko; Briš, Anamarija; Margetić, Davor; Eckert-Maksić, Mirjana

Organocatalytic activity of the new guanidine derivatives // XXIII Hrvatski skup kemičara i kemijskih inženjera, Knjiga sažetaka / Hadžiev, Andrea ; Blažeković, Zdenko (ur.).
Zagreb: Hrvatsko kemijsko društvo / Hrvatsko društvo kemijskih inženjera i tehnologa, 2013. str. 163-163 (poster, domaća recenzija, sažetak, znanstveni)

15.

Štrukil, Vjekoslav; Glasovac, Zoran; Đilović, Ivica; Matković-Čalogović, Dubravka; Šuman, Lidija; Kralj, Marijeta; Eckert-Maksić, Mirjana

Triguanide Derivatives: Synthesis, Crystal Structure and Evaluation of the Proliferation Effect on Some Tumor Cell Lines // European journal of organic chemistry, 2012 (2012), 34; 6758-6797 doi:10.1002/ejoc.201200979 (međunarodna recenzija, članak, znanstveni)

doi onlinelibrary.wiley.com

16.

Štrukil, Vjekoslav; Margetić, Davor; Igrc, Marina Diana; Eckert-Maksić, Mirjana; Friščić, Tomislav

Desymmetrisation of aromatic diamines and synthesis of non-symmetrical thiourea derivatives by click-mechanochemistry // Chemical communications, 48 (2012), 78; 9705-9707 doi:10.1039/C2CC34013E (međunarodna recenzija, članak, znanstveni)

doi pubs.rsc.org

17.

Antol, Ivana; Eckert-Maksić, Mirjana; Vazdar, Mario; Ruckenbauer, Matthias; Lischka, Hans

QM/MM nonadiabatic decay dynamics of formamide in polar and nonpolar solvents // Physical Chemistry Chemical Physics, 14 (2012), 38; 13262-13272 doi:10.1039/C2CP41830D (međunarodna recenzija, članak, znanstveni)

doi pubs.rsc.org

18.

Štrukil, Vjekoslav; Igrc, Marina Diana; Fábián, László; Eckert-Maksić, Mirjana; Childs, Scott L.; Reid, David G.; Duer, Melinda J.; Halasz, Ivan; Mottilloe, Cristina; Friščić, Tomislav

A model for a solvent-free synthetic organic research laboratory: click-mechanosynthesis and structural characterization of thioureas without bulk solvents // Green chemistry, 14 (2012), 9; 2462-2473 doi:10.1039/C2GC35799B (međunarodna recenzija, članak, znanstveni)

doi pubs.rsc.org

19.

Štrukil, Vjekoslav; Friščić, Tomislav; Eckert-Maksić, Mirjana

Solvent-free quantitative synthesis of thiourea organocatalysts and anion sensors by click-mechanochemistry // Book of abstracts Challenges in Organic Chemistry and Chemical Biology (ISACS7)
Edinburgh: The Royal Society of Chemistry, 2012. (poster, međunarodna recenzija, sažetak, znanstveni)

20.

Štrukil, Vjekoslav; Fábián, L.; Reid, D. G.; Duer, M. J.; Jackson, G. J.; Eckert-Maksić, Mirjana; Friščić, Tomislav; Margetić, Davor

Mechanochemical synthesis of guanidine - Zinc and Cadmium metal-organic frameworks // Book of abstracts Challenges in Organic Chemistry and Chemical Biology (ISACS7)
Edinburgh: The Royal Society of Chemistry, 2012. (poster, međunarodna recenzija, sažetak, znanstveni)

21.

Margetić, Davor; Eckert-Maksić, Mirjana; Štrukil, Vjekoslav

Density functional study of cimetidine complexation with metals // GECOM-CONCOORD 2012 Conference on Coordination Chemistry, Organometallic Chemistry and Catalysis / Plasseraud, Laurent (ur.).
Métabief, 2012. str. P-22 (poster, međunarodna recenzija, sažetak, znanstveni)

22.

Štrukil, Vjekoslav; Friščić, Tomislav; Eckert-Maksić, Mirjana

Solvent-free quantitative synthesis of thiourea organocatalysts and anion sensors by click-mechanochemistry // GECOM-CONCOORD 2012 Conference on Coordination Chemistry, Organometallic Chemistry and Catalysis / Plasseraud, Laurent (ur.).
Métabief, 2012. str. P-20 (poster, međunarodna recenzija, sažetak, znanstveni)

23.

Štrukil, Vjekoslav; Igrc, Marina Diana; Eckert- Maksić, Mirjana; Friščić, Tomislav

Click mechanochemistry: quantitative synthesis of "ready to use" chiral organocatalysts by efficient two-fold thiourea coupling on vicinal diamines // Chemistry : a European journal, 18 (2012), 27; 8464-8473 doi:10.1002/chem.201200632 (međunarodna recenzija, članak, znanstveni)

doi onlinelibrary.wiley.com onlinelibrary.wiley.com

24.

Friščić, Tomislav; Halasz, Ivan; Štrukil, Vjekoslav; Eckert-Maksić, Mirjana; Dinnebier, Robert E.

Clean and efficient synthesis using mechanochemistry : coordination polymers, open metal-organic frameworks and metallodrugs // Croatica chemica acta, 85 (2012), 3; 367-378 doi:10.5562/cca2014 (međunarodna recenzija, pregledni rad, znanstveni)

doi fulir.irb.hr

25.

Štrukil, Vjekoslav; Đilović, Ivica; Matković-Čalogović, Dubravka; Saame, Jaan; Leito, Ivo; Šket, Primož; Plavec, Janez; Eckert-Maksić, Mirjana

Molecular Structure and Acid/Base Properties of 1, 2-dihydro-1, 3, 5-triazine Derivatives // New journal of chemistry, 36 (2012), 1; 86-96 doi:10.1039/C1NJ20595A (međunarodna recenzija, članak, znanstveni)

doi pubs.rsc.org

26.

Barbatti, Mario; Ruckenbauer, Matthias; Szymczak, Jaroslaw, J.; Sellner, Bernhard; Vazdar, Mario; Antol, Ivana; Eckert-Maksić, Mirjana; Lischka, Hans

Model systems for dynamics of pi-conjugated biomolecules in excited states // Handbook of Computational Chemistry / Leszczynski, Jerzy (ur.).
Berlin : Heidelberg: Springer, 2012. str. 1175-1213

27.

Margetić, Davor; Štrukil, Vjekoslav; Igrc, Marina Diana; Fábián, Lászlo; Eckert-Maksić, Mirjana; Friščić, Tomislav

Environmentally-friendly organic chemistry without bulk organic solvent: mechanochemical synthesis of thioureas // International Symposium on Surface Science (ISSS-6), Abstracts / Tomi Hashizume (ur.).
Tokyo: The Surface Science Society of Japan, 2011. str. 337-337 (predavanje, međunarodna recenzija, sažetak, znanstveni)

28.

Margetić, Davor; Štrukil, Vjekoslav; Igrc, Marina Diana; Fábián, Laszlo; Eckert-Maksić, Mirjana; Friščić, Tomislav

Environmentally-friendly organic chemistry without bulk organic solvent: mechanochemical synthesis of thioureas // International Symposium on catalysis and Fine Chemicals 2011, Programs and abstracts / Kotohiro Nomura (ur.).
Nara: Catalysis society of Japan, 2011. str. 241-241 (poster, međunarodna recenzija, sažetak, ostalo)

29.

Glasovac, Zoran; Eckert-Maksić, Mirjana; Maksić, Zvonimir B.

Influence of different dielectric continuum solvent models on the accuracy of pKa Values // The 13th European Symposium on Organic Reactivity - Book of Abstracts / Burk, Peeter (ur.).
Tartu: 978-9985-4-0670-0, 2011. (poster, međunarodna recenzija, sažetak, znanstveni)

Pristup cjelovitom tekstu rada

30.

Eckert-Maksić, Mirjana; Antol, Ivana; Vazdar, Mario; Ruckenbauer, Mattias; Lischka, Hans

Effect of environment on the nonadiabatic excited-state dynamics of formamide // The 13th European Symposium on Organic Reactivity - Book of Abstracts / Burk, Peeter (ur.).
Tartu: University of Tartu, Institute of Chemistry, 2011. (predavanje, međunarodna recenzija, sažetak, znanstveni)

31.

Štrukil, Vjekoslav; Igrc, Marina Diana; Friščić, Tomislav; Eckert-Maksić, Mirjana

A Green Route Towards Sustainable Organic Synthesis - Exploiting the Power of Mechanochemistry // 17th European Symposium on Organic Chemistry / Orfanopoulos, Michael (ur.).
Hersonissos: University of Crete, 2011. (poster, međunarodna recenzija, sažetak, znanstveni)

32.

Štrukil, Vjekoslav; Igrc, Marina Diana; Fábián, Lászlo; Eckert-Maksić, Mirjana; Friščić, Tomislav

Organic Chemistry Without Bulk Organic Solvent - Mechanochemical Opportunities for an Environmentally-Friendly Research // The 2nd Symposium on Mechanochemistry and Solvent-free Synthesis / James, Stuart (ur.).
Belfast: Queen’s University of Belfast, 2011. str. 26-26 (poster, međunarodna recenzija, sažetak, znanstveni)

33.

Štrukil, Vjekoslav; Fábián, László; Reid, David G.; Duer, Melinda J.; Jackson, Graham J.; Eckert-Maksić, Mirjana; Friščić, Tomislav

Mechanochemical synthesis of zinc and cadmium metal-organic frameworks // Znanstveni susreti 3. vrste
Zagreb, 2011. (poster, domaća recenzija, sažetak, stručni)

zs3v.irb.hr

34.

Jušinski, Iva; Glasovac, Zoran; Schroeder, Detlef; Eckert-Maksić, Mirjana

Istraživanje protoniranih bisgvanidina i bisbigvanida spektrometrijom masa // Znanstveni susreti 3. vrste
Zagreb, 2011. (poster, domaća recenzija, sažetak, stručni)

zs3v.irb.hr

35.

Pavošević, Fabijan; Eckert-Maksić, Mirjana; Maksić, Zvonimir B.

Bond-stretch isomerism in 1, 3-disilabicyclo[1.1.0]butane by the computational chemistry approach // Ninth Triennial Congress of the World Association ot Theoretical and Computational Chemists / Yáñez, Manuel ; Mó, Otilia (ur.).
Santiago de Compostela, 2011. (poster, međunarodna recenzija, sažetak, znanstveni)

36.

Eckert-Maksić, Mirjana

Formamide as the model compound for photodissociation of the peptide bond // Ninth Triennial Congress of the World Association ot Theoretical and Computational Chemists / Yáñez, Manuel ; Mó, Otilia (ur.).
Santiago de Compostela, 2011. (pozvano predavanje, međunarodna recenzija, sažetak, znanstveni)

37.

Antol, Ivana; Eckert-Maksić, Mirjana; Maksić, Zvonimir B.

The influence of multiple fluorination on alleged valence isomerisation of [2.2.2]propellanes // Ninth Triennial Congress of the World Association ot Theoretical and Computational Chemists / Yáñez, Manuel ; Mó, Otilia (ur.).
Santiago de Compostela, 2011. str. PI-173 (poster, međunarodna recenzija, sažetak, znanstveni)

38.

Štrukil, Vjekoslav; Fábián, László; Reid, David G.; Duer, Melinda J.; Jackson, Graham J.; Eckert-Maksić, Mirjana; Friščić, Tomislav

Mechanochemical Synthesis of Zinc and Cadmium Metal-Organic Frameworks – The Story of Dimensionality and Solid-State Reactivity // XX International Conference on the Chemistry of the Organic Solid State / Guru Row, T. N. (ur.).
Bangalore: Indian Institute of Science, 2011. (poster, međunarodna recenzija, sažetak, znanstveni)

39.

Faraji, Shirin; Vazdar, Mario; Reddy, Sivaranjana V.; Eckert- Maksić, Mirjana; Lischka, Hans; Koeppel, Horst

Ab initio quantum dynamical study of the multi-state nonadiabatic photodissociation of pyrrole // The Journal of chemical physics, 135 (2011), 15; 154310, 13 doi:10.1063/1.3651536 (međunarodna recenzija, članak, znanstveni)

doi aip.scitation.org

40.

Naumov, Panče; Topcu, Yildiray; Eckert-Maksić, Mirjana; Glasovac, Zoran; Pavošević, Fabijan; Manoj, Kochunnoonny; Hara, Hideyuki

Photoinduced rearrangement of aromatic N-chloroamides to chloroaromatic amides in the solid state. Inverted PI_N―SIGMA_N occupational stability of amidyl radicals // Journal of Physical Chemistry. A, 115 (2011), 26; 7834-7848 doi:10.1021/jp203771c (međunarodna recenzija, članak, znanstveni)

doi pubs.acs.org

41.

Štrukil, Vjekoslav; Eckert-Maksić, Mirjana

Konformacijska izomerija i tautomerija u 1, 2-dihidro-1, 3, 5-triazinima – Eksperimentalni i teorijski studij // XXII. Hrvatski skup kemičara i kemijskih inženjera Knjiga sažetaka / Tomašić, Vesna ; Maduna Valkaj, Karolina (ur.).
Zagreb: Hrvatsko društvo kemijskih inženjera i tehnologa: Hrvatsko kemijsko društvo, 2011. (poster, domaća recenzija, sažetak, znanstveni)

42.

Jušinski, Iva; Glasovac, Zoran; Schroeder, Detlef; Eckert-Maksić, Mirjana

Istraživanje protoniranih bisgvanidina i bisbigvanida spektrometrijom masa // XXII. Hrvatski skup kemičara i kemijskih inženjera Knjiga sažetaka / Tomašić, Vesna ; Maduna Valkaj, Karolina (ur.).
Zagreb: Hrvatsko društvo kemijskih inženjera i tehnologa: Hrvatsko kemijsko društvo, 2011. (poster, domaća recenzija, sažetak, znanstveni)

43.

Trošelj, Pavle; Briš, Anamarija; Eckert-Maksić, Mirjana; Margetić, Davor

Cikloadicijske reakcije potpomognute mikrovalnim zračenjem u sintezi polinorbornana // XXII. Hrvatski skup kemičara i kemijskih inženjera Knjiga sažetaka / Tomašić, Vesna ; Maduna Valkaj, Karolina (ur.).
Zagreb: Hrvatsko društvo kemijskih inženjera i tehnologa: Hrvatsko kemijsko društvo, 2011. (predavanje, domaća recenzija, sažetak, znanstveni)

44.

Štrukil, Vjekoslav; Fábián, László; Reid, David G.; Duer, Melinda J.; Jackson, Graham J.; Eckert-Maksić, Mirjana; Friščić, Tomislav

Ususret ekološki prihvatljivom laboratoriju –Primjer metal-organske mehanokemijske sinteze // XXII. Hrvatski skup kemičara i kemijskih inženjera Knjiga sažetaka / Tomašić, Vesna ; Maduna Valkaj, Karolina (ur.).
Zagreb: Hrvatsko društvo kemijskih inženjera i tehnologa: Hrvatsko kemijsko društvo, 2011. (predavanje, domaća recenzija, sažetak, znanstveni)

45.

Margetić, Davor; Zrinski Antonac, Irena; Glasovac, Zoran; Eckert-Maksić, Mirjana; Maksimović, Ljiljana

Reactions of Dimethyl Carbonate with aliphatic Amines under High Pressure // Synthetic communications, 41 (2011), 15; 2283-2289 doi:10.1080/00397911.2010.501644 (međunarodna recenzija, članak, znanstveni)

doi www.tandfonline.com doi.org

46.

Škorić, Irena; Pavošević, Fabijan; Vazdar, Mario; Marinić, Željko; Šindler-Kulyk, Marija; Eckert-Maksić, Mirjana; Margetić, Davor

Thermal reaction of [3,4]-benzo-8-substituted-3Z,5Z,7E-octatetraenes and quantum-chemical study of the (8π,6π)-electrocyclisation // Organic & biomolecular chemistry, 9 (2011), 19; 6771-6778 doi:10.1039/c1ob05802a (međunarodna recenzija, članak, znanstveni)

Pristup cjelovitom tekstu rada doi pubs.rsc.org dx.doi.org

47.

Eckert-Maksić, Mirjana

Svečana proslava 60. obljetnice Instituta Ruđer Bošković // Kemija u industriji : časopis kemičara i tehnologa Hrvatske, 59 (2010), 12; 624-626 (podatak o recenziji nije dostupan, osvrt, ostalo)

fulir.irb.hr

48.

Naumov, Panče; Topcu, Yildiray; Eckert-Maksić, Mirjana; Pavošević, Fabijan; Kochunnoonny, Manoj; Glasovac, Zoran

Photoinduced rearrangement of N-chlorinated acetanilides and benzanilides to chloroaromatic amides in the solid state: Inverted relative stability of PI_N and SIGMA_N amidyl radicals // AsCA 2010 The 10th Conference of the Asian Crystallographic Association Program / Se Won Suh (ur.).
Busan: SungKyunKwan University, 2010. str. MS05-P76 (poster, međunarodna recenzija, sažetak, znanstveni)

49.

Štrukil, Vjekoslav

Priprava, struktura i reaktivnost novih derivata trigvanida, 2010., doktorska disertacija, Prirodoslovno-matematički fakultet, Zagreb

50.

Štrukil, Vjekoslav; Fábián, László; Reid, David G.; Duer, Melinda J.; Jackson, Graham J.; Eckert-Maksić, Mirjana; Friščić, Tomislav

Towards an environmentally-friendly laboratory: dimensionality and reactivity in the mechanosynthesis of metal-organic compounds // Chemical communications, 46 (2010), 9191-9193 doi:10.1039/C0CC03822A (međunarodna recenzija, kratko priopcenje, znanstveni)

doi pubs.rsc.org

51.

Eckert-Maksić, Mirjana; Pavošević, Fabijan; Glasovac, Zoran; Naumov, Panče

Computational study of the amidyl radicals conjugated with phenyl ring // 46th Symposium on Theoretical Chemistry - Quantum Chemistry for Large and Complex Systems: From Theory to Algorithms and Applications - Book of Abstracts / Grimme, Stefan ; Mueck-Lichtenfeld, Christian (ur.).
Münster: Westfaelische Wilhelms Universitaet Muenster, 2010. str. P41-P41 (poster, međunarodna recenzija, sažetak, znanstveni)

52.

Eckert-Maksić, Mirjana; Maksić, Zvonimir B.,

Multireference AQCC study of Hoffman-Bošković bond-stretch isomerization reactions // Fifteenth International Workshop on Quantum Systems in Chemistry and Physics (QSCP-XV) Conference Programme and Abstracts / Elliott, Stephen (ur.).
Cambridge: Magdalene College University of Cambridge, 2010. str. 91-91 (poster, međunarodna recenzija, sažetak, znanstveni)

53.

Eckert-Maksić, Mirjana; Vazdar, Mario; Ruckenbauer, Matthias; Barbatti, Mario; Müller, Thomas; Lischka, Hans

Matrix-Controlled Photofragmentation of Formamide: Dynamics Simulation in Argon by Nonadiabatic QM/MM Method // Physical Chemistry Chemical Physics, 12 (2010), 39; 12719-12726 doi:10.1039/C0CP00174K (međunarodna recenzija, članak, znanstveni)

doi pubs.rsc.org

54.

Schroeder, Detlef; Duchačkova, Lucie; Jušinski, Iva; Eckert-Maksić, Mirjana; Heyda, Jan; Tuma, Lukaš; Jungwirth, Pavel

Characterization of the Triple Ion [(CH3)4N+ . PF6- . (CH3)4N+] in the Gas Phase // Chemical physics letters, 490 (2010), 1-3; 14-18 doi:10.1016/j.cplett.2010.03.019 (međunarodna recenzija, članak, znanstveni)

doi www.sciencedirect.com doi.org

55.

Eckert-Maksić, Mirjana; Antol, Ivana; Vazdar, Mario; Barbatti, Mario; Lischka, Hans

Formamide as the Model Compound for Photodissociation Studies of the Peptide Bond, Kinetics and Dynamics // Kinetics and Dynamics: From Nano- to Bio-Scale / Paneth, P. ; Dybala-Defratyka, A. (ur.)., 2010. str. 77-107 doi:10.1007/978-90-481-3034-4_3

doi link.springer.com doi.org

56.

Margetić, Davor; Eckert-Maksić, Mirjana; Trošelj, Pavle; Marinić, Željko

Reaction of 2, 5-bis-trifluoromethyl-1, 3, 4-oxadiazole with 7- oxanorbornenes revisited: experimental and quantum-chemical study of reaction stereospecificity // Journal of fluorine chemistry, 131 (2010), 3; 408-416 doi:10.1016/j.jfluchem.2009.12.012 (međunarodna recenzija, članak, znanstveni)

doi www.sciencedirect.com doi.org

57.

Štrukil, Vjekoslav; Fábián, Lászlo; Reid, David G.; Duer, Melinda J.; Eckert-Maksić, Mirjana; Friščić, Tomislav

A Mechanochemical Approach Towards Solvent-Free Synthesis // Symposium on Mechanochemistry and Solvent-free Synthesis / James ; Stuart (ur.).
Belfast: Queen’s University of Belfast, 2009. str. 32-32 (poster, međunarodna recenzija, sažetak, znanstveni)

58.

Eckert-Maksić, Mirjana; Antol, Ivana

Study of the mechanism of the N−CO photodissociation in N, N-dimethylformamide by direct trajectory surface hopping simulations // The Journal of Physical Chemistry A, 113 (2009), 45; 12582-12590 doi:10.1021/jp9046177 (međunarodna recenzija, članak, znanstveni)

doi pubs.acs.org

59.

Eckert-Maksić, Mirjana; Lischka, Hans; Maksić, Zvonimir B.; Vazdar, Mario

The Isomerization Barrier in Cyanocyclobutadienes: An ab Initio Multireference Average Quadratic Coupled Cluster Study // Journal of Physical Chemistry A, 113 (2009), 29; 8351-8358 doi:10.1021/jp9015273 (međunarodna recenzija, članak, znanstveni)

doi pubs.acs.org doi.org

60.

Eckert-Maksić, Mirjana

Formamide as the Model for Photodissociation Studies of the Peptide Bond // COST D37 Grid Computing in Chemistry: GRIDCHEM
Prag, Češka Republika, 2009. (predavanje, pp prezentacija, znanstveni)

61.

Vazdar, Mario; Eckert-Maksić, Mirjana; Barbatti, Mario; Lischka, Hans

Theoretical investigation of the nonadiabatic deactivation of pyrrole // XXI. Hrvatski skup kemičara i kemijskih inženjera – Knjiga sažetaka / Novak, Predrag ; Pičuljan, Katarina ; Smolec, Sonja (ur.).
Zagreb: Hrvatsko društvo kemijskih inženjera i tehnologa (HDKI), 2009. str. 182-182 (poster, sažetak, znanstveni)

62.

Vazdar, Mario; Eckert-Maksić, Mirjana; Barbatti, Mario; Lischka, Hans

Excited-state non-adiabatic dynamics simulations of pyrrole // Molecular physics, 107 (2009), 8-12; 845-854 doi:10.1080/00268970802665639 (međunarodna recenzija, članak, znanstveni)

doi www.tandfonline.com doi.org

63.

Glasovac, Zoran; Eckert-Maksić, Mirjana; Maksić, Zvonimir B.

Basicity of organic bases and superbases in acetonitrile by the polarized continuum model and DFT calculations // New journal of chemistry, 33 (2009), 3; 588-597 doi:10.1039/b814812k (međunarodna recenzija, članak, znanstveni)

doi www.rsc.org

64.

Vazdar, Mario

Ab initio studij istezne izomerizacije ciklobutadiena i njegovih derivata, 2008., doktorska disertacija, Prirodoslovno-matematički fakultet, Zagreb

65.

Marinić, Željko; Trošelj, Pavle; Eckert-Maksić, Mirjana; Margetić, Davor

Spectroscopic and Quantum_Chemical Assignments of Stereochemistry of Products Obtained by 1, 3-dipolar Cycloaddition Reactions of Substituted 1, 3, 4-oxadiazoles With Norbornenes // Abstracts of the XXIX European Congress on Molecular Spectroscopy : EUCMOS 2008 / Musić, Svetozar ; Ristić, Mira ; Krehula, Stjepko (ur.).
Opatija, Hrvatska, 2008. str. 243-243 (poster, sažetak, znanstveni)

66.

Eckert-Maksić, Mirjana; Antol, Ivana; Vazdar, Mario; Barbatti, Mario; Lischka, Hans

Photochemistry of formamide and its protonated forms – An ab initio surface hopping dynamics simulations // 7th European Conference on Computational Chemistry : Book of abstracts / Polimeno, Antonino ; Casarin, Maurizio ; Olivucci, Massimo ; Laganá, Antonio (ur.).
Venecija: Universita degli studi di Padova, 2008. str. 105-106 (poster, međunarodna recenzija, sažetak, znanstveni)

67.

Vazdar, Mario; Eckert-Maksić, Mirjana; Barbatti, Mario Barbatti; Aquino, Adélia J. A. Aquino, Lischka, Hans

The mechanism of the nonadiabatic deactivation of pyrrole // Abstracts of the Central European Symposium on Theoretical Chemistry 2008 : CESTC 2008 / Čarsky, Petr (ur.).
Prag, 2008. str. 50-51 (poster, sažetak, znanstveni)

68.

Tintaru, Aura; Roithová, Jana; Schröder, Detlef; Charles, Laurence; Jušinski, Iva; Glasovac, Zoran; Eckert-Maksić, Mirjana

Generation and dissociation pathways of singly and doubly protonated bisguanidines in the gas phase // Journal of Physical Chemistry A, 112 (2008), 47; 12097-12103 doi:10.1021/jp805897f (međunarodna recenzija, članak, znanstveni)

doi pubs.acs.org

69.

Eckert-Maksić, Mirjana; Glasovac, Zoran; Trošelj, Pavle; Kütt, Agnes; Rodima, Toomas; Koppel, Ivar; Koppel, Ilmar A.

Basicity of guanidines with heteroalkyl side chains in acetonitrile // European Journal of Organic Chemistry, 2008 (2008), 30; 5176-5184 doi:10.1002/ejoc.200800673 (međunarodna recenzija, članak, znanstveni)

doi www3.interscience.wiley.com

70.

Antol, Ivana; Eckert-Maksić, Mirjana; Ončák, Milan; Slavíček, Petr; Lischka, Hans

Photodissociation pathways of acetone upon excitation into the 3s Rydberg state: adiabatic versus diabatic mechanism // Collection of Czechoslovak chemical communications, 73 (2008), 11; 1475-1494 doi:10.1135/cccc20081475 (međunarodna recenzija, članak, znanstveni)

doi cccc.uochb.cas.cz

71.

Glasovac, Zoran; Eckert-Maksić, Mirjana

AIM and NBO analysis of the intramolecular hydrogen bond in guanidine derivatives // 19th IUPAC Conference on Physical Organic Chemistry : Abstracts / Leis, José R. ; García-Río, Luís ; Santaballa, Arturo ; Canle, Moisés ; Mejuto, Juan C. (ur.).
Santiago de Compostela: The Royal University of Santiago de Compostela, 2008. str. 215-215 (poster, međunarodna recenzija, sažetak, znanstveni)

72.

Eckert-Maksić, Mirjana; Antol, Ivana; Vazdar, Mario; Barbatti, Mario; Lischka, Hans

Dynamic simulations of photodissociations of formamide and its protonated form in the gas phase // Book of Abstracts of the 19th IUPAC Conference on Physical Organic Chemistry / Leis, José R. ; García-Río, Luís ; Santaballa, Arturo ; Canle, Moisés ; Mejuto, Juan C. (ur.).
Santiago de Compostela: The Royal University of Santiago de Compostela, 2008. str. 74-74 (predavanje, međunarodna recenzija, sažetak, znanstveni)

73.

Antol, Ivana; Vazdar, Mario; Barbatti, Mario; Eckert-Maksić, Mirjana

An ab initio surface hopping dynamics study on the photodeactivation processes in protonated formamide // Electron correlation and molecular dynamics for excited states and photochemistry Symposium in honor of Hans Lischka´s 65th birthday : Book of Abstracts / Aquino, A. J. Adélia (ur.).
Beč: Erwin Schrödinger Institute (ESI), 2008. str. 34-34 (poster, međunarodna recenzija, sažetak, znanstveni)

74.

Vazdar, Mario; Barbatti, Mario; Aquino, Adélia J. A.; Eckert-Maksić, Mirjana; Lischka, Hans

The nonadiabatic deactivation paths of pyrrole // Electron correlation and molecular dynamics for excited states and photochemistry Symposium in honor of Hans Lischka´s 65th birthday : Abstracts / Aquino, A. J. Adélia ; (ur.).
Beč: Erwin Schrödinger Institute (ESI), 2008. str. 35-35 (poster, međunarodna recenzija, sažetak, znanstveni)

75.

Antol, Ivana; Vazdar, Mario; Barbatti, Mario; Eckert-Maksić, Mirjana

The effect of protonation on the photodissociation processes in formamide – an ab initio surface hopping dynamics study // Chemical physics, 349 (2008), 1-3; 308-318 doi:10.1016/j.chemphys.2008.01.026 (međunarodna recenzija, članak, znanstveni)

doi www.sciencedirect.com doi.org

76.

Glasovac, Zoran; Štrukil, Vjekoslav; Eckert- Maksić, Mirjana; Schröder, Detlef; Kaczorowska, Malgorzata; Schwarz, Helmut

Gas-phase proton affinities of guanidines with heteroalkyl side chains // International journal of mass spectrometry, 270 (2008), 1-2; 39-46 doi:10.1016/j.ijms.2007.11.008 (međunarodna recenzija, članak, znanstveni)

doi www.sciencedirect.com doi.org

77.

Antol, Ivana; Barbatti, Mario; Eckert-Maksić, Mirjana; Lischka, Hans

Quantum chemical calculations of electronically excited states: formamide, its protonated form and alkali cation complexes as case studies // Monatshefte für Chemie, 139 (2008), 4; 319-328 doi:10.1007/s00706-007-0803-2 (međunarodna recenzija, članak, znanstveni)

doi www.springerlink.com

78.

Vazdar, Mario; Eckert-Maksić, Mirjana; Lischka, Hans; Maksić, Zvonimir B.

The Izomerization Barrier in Cyanocyclobutadienes - An ab initio MR-AQCC Study // Central European Symposium on Theoretical Chemistry 2007
Litschau, Austrija, 2007. str. 23-24 (predavanje, sažetak, znanstveni)

79.

Glasovac, Zoran; Vazdar, Mario; Eckert-Maksić, Mirjana; Margetić, Davor

Proton affinities of dehydroporphyrin and subporphyrin in ground and excited states obtained by high level computations // Abstracts of the eleventh electronic computational chemistry conference : ECCC-11 / Topper, Robert Q. ; Dmitrenko, Olga (ur.).
elektronska konferencija, 2007. (poster, međunarodna recenzija, sažetak, znanstveni)

80.

Margetić, Davor; Eckert-Maksić, Mirjana; Murata, Yasujiro; Komatsu, Koichi; Milić, Dalibor; Matković-Čalogović, Dubravka; Prugovečki, Biserka; Đilović, Ivica

Experimental and Computational Investigation of Double Bond Pyramidalization in 7-sila and 7-germanorbornenes // XX. jubilarni hrvatski skup kemičara i kemijskih inženjera : knjiga sažetaka
Zagreb, 2007. str. 161-161 (poster, međunarodna recenzija, sažetak, znanstveni)

81.

Margetić, Davor; Eckert-Maksić, Mirjana; Komatsu, Koichi; Murata, Yasujiro

Double Bond Pyramidalization In 7-Sila- And 7-Germanorbornenes: An Experimental And Computational Investigation // Abstracts of the 14th IUPAC International Symposium on Organometallic Chemistry Directed Towards Organic Synthesis : OMCOS 14
Nara, 2007. (poster, međunarodna recenzija, sažetak, znanstveni)

82.

Antol, Ivana; Eckert-Maksić, Mirjana; Barbatti, Mario; Lischka, Hans

Simulation of the photodeactivation of formamide in the n(O)-pi* and pi-pi* states: an ab initio on-the-fly surface-hopping dynamics study // The Journal of chemical physics, 127 (2007), 23; 234303, 8 doi:10.1063/1.2804862 (međunarodna recenzija, članak, znanstveni)

doi aip.scitation.org

83.

Eckert-Maksić, Mirjana; Antol, Ivana; Vazdar, Mario

Comparison of TD-DFT and MRCI calculated vertical excitation energies for formamide and its cationized forms // 12th International Conference on the Applications of Density Functional Method in Physics and Chemistry : Programme and Abstractbook / Baerends, Evert Jan (ur.).
Amsterdam: HRMC Congresorganisatie, 2007. str. 123-123 (poster, međunarodna recenzija, sažetak, znanstveni)

84.

Antol, Ivana; Barbatti, Mario; Eckert-Maksić, Mirjana; Lischka, Hans

Theoretical study of formamide photodissociation using an ab initio on-the-fly surface-hopping approach // Femtochemistry and Femtobiology 8 : Book of Abstracts / Clary, David (ur.).
Oxford: Magdalen College, 2007. str. 40-40 (poster, međunarodna recenzija, sažetak, znanstveni)

85.

Glasovac, Zoran; Štrukil, Vjekoslav; Eckert-Maksić, Mirjana; Schroeder, Detlef; Kaczorowska, Malgorzata; Schwarz, Helmut

Influence of Intramolecular Hydrogen Bond on the Gas-phase Proton Affinity of Guanidines // The 15th European Symposium on Organic Chemistry : Abstracts / Guiry, Pat ; Mooney, Ann (ur.).
Dublin: University Colledge Dublin, 2007. str. 174-174 (poster, međunarodna recenzija, sažetak, znanstveni)

86.

Štrukil, Vjekoslav; Glasovac, Zoran; Eckert-Maksić, Mirjana

Computational study of triguanide cyclization // 11th European Symposium on Organic Reactivity : ESOR : Book of Abstracts / Concalves, Pedro M. L. ; Lurdes Cristiano, Maria S. (ur.).
Faro: Digitalinvest, Lda, 2007. str. 207-207 (poster, međunarodna recenzija, sažetak, znanstveni)

87.

Eckert-Maksić, Mirjana; Glasovac, Zoran; Strukil, Vjekoslav

Guanidines - from Theory to Synthesis and Applications // 50th Anniversary meeting Challenges in Organic Chemistry & Eight Tetrahedron Symposium : Abstracts / Waldmann, Herbert (ur.).
Berlin: Elsevier, 2007. str. P3.139-P3.139 (poster, međunarodna recenzija, sažetak, znanstveni)

88.

Eckert-Maksić, Mirjana; Margetić, Davor

High-pressure synthesis of novel organometallic electron donor-electron acceptor polycyclic dyads // High Pressure Research, 27 (2007), 1; 109-114 (međunarodna recenzija, članak, znanstveni)

89.

Antol, Ivana; Eckert-Maksić, Mirjana; Lischka, Hans; Maksić, Zvonimir B.

[2.2.2]Propellane Isomerization via Grob Rearrangement - An Ab Initio MR-AQCC Study // European Journal of Organic Chemistry, 2007 (2007), 19; 3173-3178 (međunarodna recenzija, članak, znanstveni)

90.

Vazdar, Mario; Eckert-Maksić, Mirjana; Barbatti, Mario; Aquino, Adélia J. A.; Lischka, Hans

Mehanizam neadijabatske deaktivacije pirola // XX. jubilarni hrvatski skup kemičara i kemijskih inženjera : Knjiga sažetaka / Vrsalović Presečki, Ana ; Findrik, Zvjezdana (ur.).
Zagreb: Hrvatsko društvo kemijskih inženjera i tehnologa, Hrvatsko kemijsko društvo, 2007. str. 160-160 (poster, domaća recenzija, sažetak, znanstveni)

91.

Trošelj, Pavle; Zrinski-Antonac, Irena; Margetić, Davor; Glasovac, Zoran; Eckert-Maksić, Mirjana

Karboksimetiliranje anilina i fenola pod utjecajem mikrovalnog zračenja // XX. jubilarni hrvatski skup kemičara i kemijskih inženjera : Knjiga sažetaka / Vrsalović Presečki, Ana ; Findrik, Zvjezdana (ur.).
Zagreb: Hrvatsko društvo kemijskih inženjera i tehnologa, Hrvatsko kemijsko društvo, 2007. str. 57-57 (poster, domaća recenzija, sažetak, znanstveni)

92.

Štrukil, Vjekoslav; Glasovac, Zoran; Eckert-Maksić, Mirjana

Studij reaktivnosti monosupstituiranih gvanidina s karbodiimidom // XX. jubilarni hrvatski skup kemičara i kemijskih inženjera : Knjiga sažetaka / Vrsalović Presečki, Ana ; Findrik, Zvjezdana (ur.).
Zagreb: Hrvatsko društvo kemijskih inženjera i tehnologa, Hrvatsko kemijsko društvo, 2007. str. 58-58 (poster, domaća recenzija, sažetak, znanstveni)

93.

Glasovac, Zoran; Eckert-Maksić, Mirjana

Intramolekulska vodikova veza : građevni blok u dizajnu superbaza // XX. jubilarni hrvatski skup kemičara i kemijskih inženjera : Knjiga sažetaka / Vrsalović Presečki, Ana ; Findrik, Zvjezdana (ur.).
Zagreb: Hrvatsko društvo kemijskih inženjera i tehnologa, Hrvatsko kemijsko društvo, 2007. str. 162-162 (poster, domaća recenzija, sažetak, znanstveni)

94.

Antol, Ivana; Eckert-Maksić, Mirjana; Lischka, Hans; Maksić, Zvonimir B.

Ab initio MR-AQCC studij "bond stretch" izomerizacije [2.2.2]propelana // XX. hrvatski skup kemičara i kemijskih inženjera : Knjiga sažetaka / Vrsalović Presečki, Ana ; Findrik, Zvjezdana (ur.).
Zagreb: Hrvatsko društvo kemijskih inženjera i tehnologa, Hrvatsko kemijsko društvo, 2007. str. 163-163 (poster, domaća recenzija, sažetak, znanstveni)

95.

Eckert-Maksić, Mirjana; Glasovac, Zoran

Computational Study of Deprotonation of Cyclopropa-Fused Quinones // Polish Journal of Chemistry, 81 (2007), 5-6; 1109-1121 (međunarodna recenzija, članak, znanstveni)

96.

Barbatti, M.; Granucci, G.; Persico, M.; Ruckenbauer, M.; Vazdar, Mario; Eckert-Maksić, Mirjana; Lischka, H.

The on-the-fly surface-hopping program system NEWTON-X: application to ab initio simulation of the nonadiabatic photodynamics of benchmark systems // Journal of Photochemistry and Photobiology A, 190 (2007), 2-3; 228-240 (međunarodna recenzija, članak, znanstveni)

www.sciencedirect.com

97.

Margetić, Davor; Eckert-Maksić, Mirjana; Antol, Ivana; Vazdar, Mario

Quantum Chemical Study on the Effects of Incorporation of Silicon and Germanium Bridges on Pyramidalization of Olefinic Carbon Atoms in Sesquinorbornene Framework // Abstracts of the 12th International Congress of Quantum Chemistry
Kyoto, 2006. (poster, sažetak, znanstveni)

98.

Zrinski Antonac, Irena; Trošelj, Pavle; Margetić, Davor; Glasovac, Zoran; Eckert-Maksić, Mirjana

Microwave assisted carbomethylation of anilines and phenols // Proceedings of ECSOC-10 : The Tenth International Electronic Conference on Synthetic Organic Chemistry / Seijas, Julio A. ; Tato, M. Pilar Vázquez (ur.).
Basel: MDPI Books, 2006. (poster, međunarodna recenzija, cjeloviti rad (in extenso), znanstveni)

www.usc.es

99.

Eckert-Maksić, Mirjana; Margetić, Davor

High pressure synthesis of novel organometallic electron donor - electron acceptor polycyclic dyads // The 44th European High Pressure Research Group Conference : Abstracts
Prag, 2006. (poster, sažetak, znanstveni)

100.

Eckert-Maksić, Mirjana; Vazdar, Mario; Barbatti, Mario; Lischka, Hans; Maksić, Zvonimir B.

Automerization of Cyclobutadiene and its Barrier Height-An Ab Initio Study // 3rd Meeting of the COST working group D26/0014/03 Intrinsic Reactivity of new Molecular Materials / Eckert-Maksić, Mirjana (ur.).
Zagreb: Institut Ruđer Bošković, 2006. (poster, sažetak, znanstveni)