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Fizikinė chemija ; Physical chemistry : practical works

• Authors : Ragelienė, Lina; Mickevičius, Donatas

Subjects: Chemistry; physical and theoretical; info:eu-repo/classification/udc/541(076)

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Two-dimensional nanomaterials: research and applications

• Authors : Omastová, M.; MIčušik, M.; Bugárová, N.

Subjects: two-dimensional nanomaterials; research; applications

• Source: 4th international conference on nanomaterials: fundamentals and applications, November 10-11, 2020: online conference: book of abstracts / organized by: Department of

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Protein-ligand binding volume determined from a single 2D NMR spectrum with increasing pressure

• Authors : Skvarnavičius, Gediminas; Toleikis, Zigmantas; Michailovienė, Vilma

Subjects: protein-ligand binding volume; 2D NMR; pressure

• Source: The journal of physical chemistry. B, Washington : American Chemical Society, 2021, vol. 125, iss. 22, p. 5823-5831 ; ISSN 1520-6106 ;

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Electronic g-tensor calculations for dangling bonds in nanodiamonds

• Authors : Masys, Šarūnas; Jonauskas, Valdas; Rinkevicius, Zilvinas

Subjects: molecular-orbital methods; effective nuclear charges; surface modification

• Source: Journal of physical chemistry A, Washington, DC : American Chemical Society, 2021, vol. 125, iss. 37, p. 8249-8260 ; ISSN 1089-5639 ;

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TADF parameters in the solid state: an easy way to draw wrong conclusions

• Authors : Serevičius, Tomas; Skaisgiris, Rokas; Kreiza, Gediminas

Subjects: fluorescence; OLEDs; quantum yield

• Source: Journal of physical chemistry A, Washington : American Chemical Society, 2021, vol. 125, no. 7, p. 1637-1641 ; ISSN 1089-5639 ; eISSN

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ZnO nanostructures application in electrochemistry: influence of morphology

• Authors : Sulciute, Agne; Nishimura, Keita; Gilshtein, Evgeniia

Subjects: zinc-oxide; size distribution; nanoparticles

• Source: Journal of physical chemistry C, Washington, DC : American Chemical Society, 2021, vol. 125, iss. 2, p. 1472-1482 ; ISSN 1932-7447 ; eISSN

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VeloxChem: a python-driven density-functional theory program for spectroscopy simulations in high-performance computing environments

• Authors : Rinkevicius, Zilvinas; Li, Xin; Vahtras, Olav

Subjects: circular dichroism; density functional theory (DFT); ECD

• Source: Wiley interdisciplinary reviews: computational molecular science, Hoboken, NJ : John Wiley & Sons, 2020, vol. 10, iss. 5, art. no. e1457, p. 1-14 ; ISSN 1759-0876 ; eISSN 1759-0884

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NMR and Raman scattering studies of temperature- and pressure-driven phase transitions in CH3NH2NH2PbCl3 perovskite

• Authors : Maczka, Miroslaw; Ptak, Maciej; Militao Vasconcelos, Daniel Linhares

Subjects: transitions; perovskite; temperature

• Source: Journal of physical chemistry C, Washington : ACS publications, 2020, vol. 124, no. 49, p. 26999-27008 ; ISSN 1932-7447 ; eISSN 1932-7455

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Computational NMR study of ion pairing of 1‑decyl-3-methyl-imidazolium chloride in molecular solvents

• Authors : Lengvinaitė, Dovilė; Klimavičius, Vytautas; Balevičius, Vytautas

Subjects: solvents; anions; cations

• Source: The journal of physical chemistry B, Washington : American Chemical Society, 2020, vol. 124, no. 47, p. 10776-10786 ; ISSN 1520-6106 ;

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Diffusion enhancement in highly excited MAPbI3 perovskite layers with additives

• Authors : Ščajev, Patrik; Qin, Chuanjiang; Aleksiejūnas, Ramūnas

Subjects: Perovskite; light-induced transient grating; carrier diffusion

• Source: Journal of physical chemistry letters, Washington : American Chemical Society, 2018, vol. 9, p. 3167-3172 ; ISSN 1948-7185

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