2020

1,4‐Benzoquinone Derivatives for Enhanced Bioelectrocatalysis by Fructose Dehydrogenase from Gluconobacter Japonicus: Towards Promising D‐Fructose Biosensor Development

Voitechovič, E., Vektarienė, A., Vektaris, G., Jančienė, R., Razumienė, J., & Gurevičienė, V. (2020). 1,4‐Benzoquinone Derivatives for Enhanced Bioelectrocatalysis by Fructose Dehydrogenase from Gluconobacter Japonicus: Towards Promising D‐Fructose Biosensor Development. Electroanalysis32(5), 1005-1016 (Q2,HPC).


Dynamics of Singlet Oxygen Molecule Trapped in Silica Glass Studied by Luminescence Polarization Anisotropy and Density Functional Theory

Skuja, L., Smits, K., Trukhin, A., Gahbauer, F., Ferber, R., Auzinsh, M., … & Alkauskas, A. (2020). Dynamics of Singlet Oxygen Molecule Trapped in Silica Glass Studied by Luminescence Polarization Anisotropy and Density Functional Theory. The Journal of Physical Chemistry C124(13), 7244-7253 (Q2).


Relaxing under pressure with a rigid niccolite formate framework

Szeremeta, A. Z., Nowok, A., Sieradzki, A., Simenas, M., Vilčiauskas, L., Gągor, A., … & Pawlus, S. (2020). Relaxing under pressure with a rigid niccolite formate framework. Journal of Materials Chemistry C8(47), 16736-16741 (Q1).


Hybrid density functional theoretical study of NASICON-type NaxTi2(PO4)(3) (x=1-4)

Gryaznov, D., Stauffer, S. K., Kotomin, E. A., & Vilčiauskas, L. (2020). Hybrid density functional theoretical study of NASICON-type Na x Ti 2 (PO 4) 3 (x= 1–4). Physical Chemistry Chemical Physics22(21), 11861-11870 (Q1,HPC)


Instantaneous switching between different modes of non-photochemical quenching in plants. Consequences for increasing biomass production

van Amerongen, H., & Chmeliov, J. (2020). Instantaneous switching between different modes of non-photochemical quenching in plants. Consequences for increasing biomass production. Biochimica et biophysica acta (BBA)-Bioenergetics1861(4), 148119.DOI: 10.1016/j.bbabio.2019.148119 (Q2).


Carbazole-terminated isomeric hole-transporting materials for perovskite solar cells

Rakstys, K., Paek, S., Drevilkauskaite, A., Kanda, H., Daskeviciute, S., Shibayama, N., Daskeviciene, M., Gruodis, A., Kamarauskas, E., Jankauskas, V. and Getautis, V. & Nazeeruddin, M. K. (2020). Carbazole-terminated isomeric hole-transporting materials for perovskite solar cells. ACS applied materials & interfaces12(17), 19710-19717. DOI:10.1021/acsami.9b23495 (Q1,HPC).


From Generation to Extraction: A Time-Resolved Investigation of Photophysical Processes in Non-fullerene Organic Solar Cells

Jasiūnas, R., Zhang, H., Yuan, J., Zhou, X., Qian, D., Zou, Y., Devižis, A., Sulskus, J., Gao, F. & Gulbinas, V. (2020). From Generation to Extraction: A Time-Resolved Investigation of Photophysical Processes in Non-fullerene Organic Solar Cells. The Journal of Physical Chemistry C124(39), 21283-21292. DOI:10.1021/acs.jpcc.0c05263 (Q2).


Benchmarking the forward–backward trajectory solution of the quantum-classical Liouville equation

Braver, Y., Valkunas, L., & Gelzinis, A. (2020). Benchmarking the forward–backward trajectory solution of the quantum-classical Liouville equation. The Journal of Chemical Physics152(21), DOI: 214116.10. 1063/5.0006538 (Q1,HPC).


Extended Calculations of Energy Levels and Transition Rates for Singly Ionized Lanthanide Elements. I. Pr–Gd

Radžiūtė, L., Gaigalas, G., Kato, D., Rynkun, P., & Tanaka, M. (2020). Extended Calculations of Energy Levels and Transition Rates for Singly Ionized Lanthanide Elements. I. Pr–Gd. The Astrophysical Journal Supplement Series248(1), 17.DOI: 10.3847/1538-4365/ab8312 (Q1, HPC).


Energy Level Structure and Transition Data of Er2+

Gaigalas, G., Rynkun, P., Radžiūtė, L., Kato, D., Tanaka, M., & Jönsson, P. (2020). Energy Level Structure and Transition Data of Er2+. The Astrophysical Journal Supplement Series248(1), 13. DOI:10.3847/1538-4365/ab881a (Q1,HPC).