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Citations per year
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Cited by
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Since 2019
Citations
14
14
h-index
1
1
i10-index
1
1
0
8
4
2022
2023
2024
5
7
2
Public access
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1 article
2 articles
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Sonata Kvedaraviciute
PhD Student
Verified email at dtu.dk
Theoretical Spectroscopy
QM/MM
Classical Molecular Dynamics
ab initio Molecular Dynamics
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Year
Structural Features of the [C4mim][Cl] Ionic Liquid and Its Mixtures with Water: Insight from a
1
H NMR Experimental and QM/MD Study
D Lengvinaitė, S Kvedaraviciute, S Bielskutė, V Klimavicius, ...
The Journal of Physical Chemistry B 125 (48), 13255-13266
, 2021
13
2021
Prediction of the tautomer stability and acidity of phenacylpyridines in aqueous solution
A Cedillo, S Kvedaravičiūtė, K Aidas
Theoretical Chemistry Accounts 139 (3), 52
, 2020
1
2020
Polarizable Embedding without Artificial Boundary Polarization
S Kvedaravičiūtė, D Carrasco-Busturia, KB Møller, JMH Olsen
Journal of Chemical Theory and Computation
, 2023
2023
Tautomerizmu pasižyminčių junginių rūgštingumo konstantų modeliavimas tankio funkcionalo teorijos metodais DFT predictions of acidity constants for compounds exhibiting tautomerism
S Kvedaravičiūtė, A Cedillo, K Aidas
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