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journal article

Calculated tautomeric equilibria and X-ray structures of 2-substituted N-methoxy-9-methyl-9H-purin-6-aminesGundersen, Lise-Lotte; Görbitz, Carl Henrik; Neier, Liina; Roggen, Heidi; Tamm, ToomasTheoretical chemistry accounts2011 / p. 349-359

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journal article

Calculation of hydration enthalpies of aqueous transition metal cations using two coordination shells and central ion substitutionUudsemaa, Merle; Tamm, ToomasChemical physics letters2004 / 1/3, lk. 54-58 : ill https://www.sciencedirect.com/science/article/abs/pii/S0009261404016781

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journal article

Controlling chirogenic effects in porphyrin based supramolecular systems: theoretical analysis versus experimental observationsOsadchuk, Irina; Luts, Hanna-Eliisa; Zahharova, Aleksandra; Tamm, Toomas; Borovkov, VictorChemPhysChem2024 / art. e202400104 https://doi.org/10.1002/cphc.202400104

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dissertation

DFT study of the cesium cation containing complexes relevant to the cesium cation binding by the humic acids = DFT arvutus Cs katiooni interaktsioonidest humiinühenditega orgaaniliste mudelühendite baasilTamp, Sven2007 https://www.ester.ee/record=b2269605*est

dissertation

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journal article

Efficient defect-driven cation exchange beyond the nanoscale semiconductors toward antibacterial functionalizationPolivtseva, Svetlana; Volobujeva, Olga; Kuznietsov, Ivan; Kaupmees, Reelika; Danilson, Mati; Krustok, Jüri; Molaiyan, Palanivel; Hu, Tao; Lassi, Ulla; Klopov, Mihhail; van Gog, Heleen; van Huis, Marijn A.; Kaur, Harleen; Ivask, Angela; Rosenberg, Merilin; Gathergood, Nicholas; Ni, Chaoying; Grossberg-Kuusk, MaarjaACS applied materials @ interfaces2024 / 12 p https://doi.org/10.1021/acsami.4c11425

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journal article

Inclusion of additional coordination sphere into cluster-model redox potential calculationsUudsemaa, Merle; Tamm, ToomasAIP conference proceedings2007 / 2, p. 495-499 https://ui.adsabs.harvard.edu/abs/2007AIPC..963..495U/abstract

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journal article

Investigation of the solar cell materials Cu(In,Ga)Se2 and Cu2ZnSnS4 with muon spin spectroscopy and density-functional calculationsVilao, Rui C.; Marinopoulos, Apostolos G.; dos Santos, Diego Garcia; Alberto, Helena Vieira; Gil, Joao Campos; Mengyan, Patrick W.; Kauk-Kuusik, Marit; Lord, James; Weidinger, AloisJournal of applied physics2024 / art. 055704 https://doi.org/10.1063/5.0205837

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journal article

Isomers and conformers of complexes of Ti(OiPr)4 with cuclopentane-1,2-dione : NMR study and DFT calculationsOsadchuk, Irina; Pehk, Tõnis; Paju, Anne; Lopp, Margus; Öeren, Mario; Tamm, ToomasInternational journal of quantum chemistry2014 / p. 1012-1018 : ill

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book article

Redox potentials from DFT calculationsUudsemaa, Merle; Tamm, ToomasXIIth International Congress of Quantum Chemistry : May 21-26, 2006, Kyoto, Japan : program and abstract2006 / p. B075

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