Moksliniai straipsniai

The Transition Metal to Ligand Bonding Nature: a Quantum Chemical Study of p-Allyl-ruthenacycle

A. Vektarienė. The Transition Metal to Ligand Bonding Nature:a Quantum Chemical Study of p-Allyl-ruthenacycle. Lith. J. Phys. 58, 232–245 (2018) DOI: 10.3952/physics.v58i3.3811


Electron paramagnetic resonance of copper doped [(CH3)2NH2] [Zn(HCOO)3] hybrid perovskite framework.

M. Šimėnas, A. Ciupa, G. Usevičius, K. Aidas, D. Klose, G. Jeschke, M. Mączka, G.Völkel, A. Pöppl, J. Banys.Electron paramagnetic resonance of copper doped[(CH3)2NH2][Zn(HCOO)3] hybrid perovskite framework. Phys. Chem. Chem. Phys., 2018,20, 12097-12105 DOI: 10.1039/C8CP01426D


NMR, Raman and DFTStudy of Lyotropic Chromonic Liquid Crystals of Biomedical Interest: Tautomeric Equilibrium and Slow Self- Assembling in Sunset Yellow Aqueous Solutions.

K. Kristinaitytė, A. Maršalka, L. Dagys, K. Aidas, I. Doroshenko, Y. Vaskivskyi, Y.Chernolevska, V. Pogorelov, N.R. Valevičienė, V. Balevicius. NMR, Raman and DFTStudy of Lyotropic Chromonic Liquid Crystals of Biomedical Interest: TautomericEquilibrium and Slow Self-Assembling in Sunset Yellow Aqueous Solutions. J. Phys. Chem. B, 2018, 122 (12), 3047–3055 DOI: 10.1021/acs.jpcb.8b00350


Pulse EPR and ENDOR Study of Manganese Doped[(CH3)2NH2] [Zn(HCOO)3] Hybrid Perovskite Framework

M. Šimėnas, L. Macalik, K. Aidas, V. Kalendra, D. Klose, G. Jeschke, M. Mączka, G.Völkel, J. Banys, A. Pöppl. Pulse EPR and ENDOR Study of Manganese Doped[(CH3)2NH2] [Zn(HCOO)3] Hybrid Perovskite Framework. J. Phys. Chem. C, 2017, 121 (48), 27225– 27232 DOI: 10.1021/acs.jpcc.7b09990


Modeling Dynamic Conformations of Organic Molecules: Alkyne Carotenoids in Solution

Streckaite, S., Macernis, M., Li, F., Kuthanová Trsková, E., Litvin, R., Yang, C., … & Llansola-Portoles, M. J. (2020). Modeling Dynamic Conformations of Organic Molecules: Alkyne Carotenoids in Solution. The Journal of Physical Chemistry A124(14), 2792-2801. DOI:10.1021/acs.jpca.9b11536 (Q2,HPC)


On the Dimers Stability of Allicin and Its Derivatives Interacting with AT, GC, and DNA Bridge: DFT Study

Macernis M
J. Chem., 2017, vol. 2017, 1428508, 11 pages (https://doi.org/10.1155/2017/1428508)
2017


Detection of cancerous kidney tissue by means of SERS spectroscopy of extracellular fluid

Velicka M, Pucetaite M, Urboniene V, Ceponkus J, Jankevicius F, Sablinskas V. Detection of cancerous kidney tissue by means of SERS spectroscopy of extracellular fluid. J Raman Spectrosc. 2017;1–11. https://doi.org/10.1002/jrs.5232


Spectroscopic properties of photosystem II reaction center revisited

A Gelzinis, D Abramavicius, JP Ogilvie, L Valkunas: Spectroscopic properties of photosystem II reaction center revisited
10.1063/1.4997527. The Journal of Chemical Physics 147 (2017) 115102.


Can red-emitting state be responsible for fluorescence quenching in LHCII aggregates?

A Gelzinis, J Chmeliov, AV Ruban, L Valkunas: Can red-emitting state be responsible for fluorescence quenching in LHCII aggregates? Photosynthesis Research (2017).


Strain broadening of the 1042-nm zero phonon line of the NV− center in diamond: A promising spectroscopic tool for defect tomography

T. B. Biktagirov, A. N. Smirnov, V. Yu. Davydov, M. W. Doherty, A. Alkauskas, B. C. Gibson, and V. A. Soltamov
Phys. Rev. B 96, 075205 – Published 18 August 2017
https://journals.aps.org/prb/abstract/10.1103/PhysRevB.96.075205