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Naslov Hybridization makes the difference: [2Oxa.2Oxa.2Oxa] a sp2-Carbon dominated Lehn-type cryptand - Prediction of ion selectivity by quantum chemical calculations. XVIII (Article; Early Access)
Autori Capponi Thomas Bason Clemens Cocic Dusan C Puchta Ralph Van Eldik Rudi 
Info JOURNAL OF COORDINATION CHEMISTRY, (2024), vol. br. , str. -
Projekat Ministry of Education, Science and Technological Development of the Republic of Serbia [451-03-68/2020-14/200122]
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Naslov The ion selectivity of the Goedken-Peng cryptand: prediction of ion selectivity by quantum chemical calculations XVII (Article; Early Access)
Autori Joerg Julius Puchta Ralph Soldatovic Tanja V  Kolenovic-Serezlic Majda Van Eldik Rudi 
Info JOURNAL OF COORDINATION CHEMISTRY, (2024), vol. br. , str. -
Projekat State University of Novi Pazar, Republic of Serbia; Ministry of Science, Technological Development and Innovation of the Republic of Serbia [451-03-65/2024-03/200252]
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Naslov Effective encapsulation of noble and small gases and molecules by tubularene molecule (Article; Early Access)
Autori Weinert Christopher Cocic Dusan C Puchta Ralph Van Eldik Rudi 
Info ZEITSCHRIFT FUR ANORGANISCHE UND ALLGEMEINE CHEMIE, (2023), vol. br. , str. -
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Naslov Host-guest complexes of a cryptand based on 5H-cyclopenta[2,1-b:3,4b′]pyridine moieties: prediction of ion selectivity by quantum chemical calculations XVI (Article; Early Access)
Autori Capponi Thomas Weigel Julia Cocic Dusan C Alzoubi Basam M Van Eldik Rudi Puchta Ralph 
Info JOURNAL OF COORDINATION CHEMISTRY, (2023), vol. br. , str. -
Projekat Ministry of Education, Science and Technological Development of the Republic of Serbia [451-03-9/2023-14/200122]
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Naslov A Personal Account on Inorganic Reaction Mechanisms (Article; Early Access)
Autori Polaczek Justyna Kieca Konrad Oszajca Maria Impert Olga Katafias Anna Chatterjee Debabrata Cocic Dusan C Puchta Ralph Stochel Grazyna Hubbard Colin D Van Eldik Rudi 
Info CHEMICAL RECORD, (2023), vol. br. , str. -
Projekat National Science Centre in Poland [2019/35/B/ST4/04266, 2016/23/D/ST4/00303]; Projekt DEAL; Ministry of Education, Science and Technological Development of the Republic of Serbia [451-03-47/2023-01/200122]
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Naslov Selective Noble Gas Inclusion in Pentagon-Dodecahedral X-20-Cages (Article)
Autori Weinert Christopher Cocic Dusan C Puchta Ralph Van Eldik Rudi 
Info MOLECULES, (2023), vol. 28 br. 15, str. -
Projekat Ministry of Education, Science and Technological Development of the Republic of Serbia [451-03-47/2023-01/200122]
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Naslov Mechanistic insight on the water exchange mechanism of [Zn(tren)H2O](2+) and related complexes from a DFT study (Article)
Autori Alzoubi Basam M Cocic Dusan C Puchta Ralph Van Eldik Rudi 
Info JOURNAL OF COORDINATION CHEMISTRY, (2022), vol. 75 br. 5-6, str. 573-586
Projekat Deutsche Forschungsgemeinschaft; Al-Balqa Applied University; Ministry of Education and Science of the Republic of Serbia [451-0368/2022-14/200122]
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Naslov Investigation of water substitution at Ru-II complexes by conceptual density function theory approach (Article)
Autori Cocic Dusan C Petrovic Biljana V  Puchta Ralph Chrzanowska Marta Katafias Anna Van Eldik Rudi 
Info JOURNAL OF COMPUTATIONAL CHEMISTRY, (2022), vol. 43 br. 17, str. 1161-1175
Projekat Ministarstvo Prosvete, Nauke i Tehnoloskog Razvoja [451-03-9/2022-14/200122]; Ministry of Education, Science and Technological Development of the Republic of SerbiaMinistry of Education, Science & Technological Development, Serbia
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Naslov A theoretical mechanistic study of [K subset of [2.2.2]](+) enantiomerization (Article)
Autori Balovic Jelena Cocic Dusan C Djordjevic Sladjana V  Radenkovic Slavko Van Eldik Rudi Puchta Ralph 
Info JOURNAL OF PHYSICAL ORGANIC CHEMISTRY, (2022), vol. 35 br. 2, str. -
Projekat European Commission; Ministry of Education, Science and Technological Development, Serbia [451-03-68/2020-14/200122]
Ispravka Web of Science   Članak   Elečas   Rang časopisa   Citati: Web of Science  
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Naslov [3.2.1] and [4.1.1] isomers of Lehn's [2.2.2] Cryptand: Prediction of ion selectivity by quantum chemical calculations XV** (Article)
Autori Cocic Dusan C Manaa Aliya Siegl Selina Puchta Ralph Van Eldik Rudi 
Info ZEITSCHRIFT FUR ANORGANISCHE UND ALLGEMEINE CHEMIE, (2021), vol. 647 br. 8, str. 915-921
Projekat Ministry of Education, Science and Technological Development of the Republic of Serbia [451-03-68/2020-14/200122]; Projekt DEAL
Ispravka Web of Science   Članak   Elečas   Rang časopisa   Citati: Web of Science   Scopus  
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