Jelena Tamulienė

tamuliene dr. Jelena Tamulienė
Senior Researcher
Member of Cold Atoms and Condensed Molecular Structures Group

Room: A429
Work phone: +370 5 2234644
Email:

Research

Molekulių ir jų darinių modeliavimas ir tyrimas kvantinės chemijos metodais.

Participation at projects:

1995- assistant in G. Soros supporting research work;
1997-2000 investigator at the ERBIC15CT960746;
2000- investigator at SPC 00-4050 contract;
2001- researcher at twining program with University of California, Davis;
2002-2004- investigator NORFA "Quantum Mechanical Molecular Modelling" project;
2004-2007- investigator EU FP6 "Programmable Artificial Cell Evolution" project;
2002-2006 - Management committee member Participant of COST D27 action;
2005-2006 - Coordinator and investigator LitGrid project;
2005-2007 - applicant of the BalticGrid project;
2008 – Management committee member of COST P19 action;
2008-2012- Management committee member of COST MP082 action;
2010-2013- applicant of InSpire project;
Increasing Internationality of study programs of Department of Computer science;
2014 - 2018 Management committee member Participant of COST CM 1301 action;
2014-2016 – Leader in the project of the Lithuanian-Belarus program;
2019 Management committee member Participant of COST CA18212 - Molecular Dynamics in the GAS phase (MD-GAS);
2020- Project No. co-financed by the European Union Structural Funds. 09.2.1-ESFA-V-726-03-0001 “Development and implementation of digital education content”;
2020 - European Union Funds Investment Operational Program Priority 9 “Public Education and Increasing Human Resources Potential” implementation measure 09.3.1-ESFA-V-732 implementation measure “Improvement of the study system” project SKAR-3.

Publications

The most imortant publications:

N. Bertram, Y.D. Kim, G. Ganteför, Q. Sun, P. Jena, J. Tamuliene and G. Seifert, “Experimental and theoretical studies on inorganic magic clusters: M4X6 (M=W, Mo, X=O, S)” Chem. Phys. Lett., Vol. 396, Issue 4-6, p.p. 341-345, 2004;
V. Balevičius, Z. Gdaniec, J. Tamulienė, H Fuess, NMR and quantum chemistry study of mesoscopic structuring in 3-methylpyridine/water/NaBr mixture in the vicinity of the phase separation boundary, Phase transitions. Vol. 81, iss. 4 , p. 293-301, 2008 G. Seifert, J. Tamuliene, S. Gemming, “ Mo_nS_2n+x clusters-magic numbers and platelets”, Computational Materials Science 35, 316-320, 2006;
S. Gemming, J. Tamuliene, G. Seifert, N. Bertram, Y. D. Kim, G. Gantefor, “ Electronic and geometric structures of Mo_xS_y and W_xS_y (x=1,2,4; y=1-12) clusters, Appl. Phys. A. (2005);
Jelena Tamuliene, Julian Noll, Peter Frenzel, Tobias Rüffer, Alexander Jakob, Bernhard Walfort and Heinrich Lang, Synthesis of [{AgO ₂CCH ₂OMe(PPh ₃ )}_n ] and theoretical study of its use in focused electron beam induced deposition,Beilstein J. Nanotechnol. 2017, 8, 2615-2624. doi:10.3762/bjnano.8.262.

Main list of Clarivate Analytics Web of Science publications

A. Tamulis, J. Tamuliene, A. Graja, "Quantum Chemical ab initio investigations of non-covalent bonding derivatives of fullerene C60 and Li atom or CS2, C6H6 molecules" Fullerene Science and Technology, vol. 6, No. 6, November 1998, p.p. 1097-1109;
A. Tamulis, J. Tamuliene, M.L. Balevicius, J.M. Nunzi, "Quantum Chemical Design of Multivariable Anisotropic Random-Walk Molecular Devices Based on Stilbene and Azo-Dyes", Mol. Cryst. Liq. Cryst. Mol. Cryst. Liq. Cryst. 216 (1999), p.p. 49-54;
J. Tamuliene, A. Tamulis, M. L. Balevicius, A. Graja, "Ab Initio Quantum Chemical Methods for Investigations of Fullerene C60, CS2 and Tetrathiafulvalene Molecules and their Complexes", "Fullerene Science and Technology", vol. 8, issue 3, 2000;
A. Tamulis, R.R. Abdreimova, J. Tamuliene, M. Peruzzini, M.L. Balevicius, "Platinum Mediated Oxidative P-O Coupling of White Phosphorus and Alcohols: an Ab Initio Study", Inorganica Chimica Acta, vol. 307, p.p. 71-76, 2000;
A. Tamulis, R. R. Abdreimova, J. Tamuliene, M. Peruzzini, M. L. Balevicius "Ab initio study of cuprate-mediate oxidative P-O coupling of white phosphorus and alcohols", Inorganica Chimica Acta;
A. Tamulis, J. Tamuliene, M. L. Balevicius, Z. Rinkevicius, V. Tamulis, " Quantum Mechanical Studies of Intensity in Electronic Spectra of Fluorescein Dianion and Monoanion Forms" Structural Chemistry, Vol. 14, No.6 , 2003;
A. Tamulis, J. Tamuliene, V.Tamulis, A. Ziriakoviene, A. Graja, "Quantum Mechanical Design of Molecular Computers Elements Suitable for Self-Assembling to Quantum Computing Living Systems', Solid State Phenomena, Vol. 97-98, 2004, p.p. 173-180. ISSN: 1012-0394;
N. Bertram, Y.D. Kim, G. Ganteför, Q. Sun, P. Jena, J. Tamuliene and G. Seifert, “Experimental and theoretical studies on inorganic magic clusters: M4X6 (M=W, Mo, X=O, S)” Chem. Phys. Lett., Vol. 396, Issue 4-6, p.p. 341-345, 2004;
J. Tamuliene, M. L. Balevicius, A. Tamulis, "How Has the Bridge Fragment Chosen to Design Charge Transfer Molecular Device?" Structural Chemistry, vol. 15, No.6, p.p. 579-585, 2004;
V. Balevicius, K. Aidas, J. Tamuliene, H. Fuess, " 1H NMR and DFT study of proton exange in heterogeneous structures of pyridine-N-oxide/HCl/DCl/H2O", Spectrochimica Acta, Part A: Mol. & Biomol. Spectroscopy, vol 61/5 pp 835-839. 2005;
J. Tamuliene, A. Tamulis, V. Balevicius, L. M. Balevicius, V. Tamulis, "NMR Parameters of Aza-Fullerene and its Derivatives" Fullerenes, Nanotubes, and Carbon Nanostructures, vol.13, No.1, p.p. 65-78. 2005;
J. Tamuliene, G. Seifert, “Isomers of Endohedral Fullerene Sc₂@C₈₄ “, Fullerenes, Nanotubes, and Carbon Nanostructures, vol.13, No.4, p.p. 279-286. 2005;
S. Gemming, J. Tamuliene, G. Seifert, N. Bertram, Y. D. Kim, G. Gantefor, “ Electronic and geometric structures of Mo_xS_y and W_xS_y (x=1,2,4; y=1-12) clusters, Appl. Phys. A. (2005);
J. Tamuliene, A. Tamulis, “Quantum Mechanical investigations of sel-assembled ssytem consisting of peptide nucleic acid, sensitizer, and lipid precursor molecules, Lithuanian Journal of Physics, Vol. 45, No.3, pp. 167-174 (2005);
G. Seifert, J. Tamuliene, S. Gemming, “ Mo_nS_2n+x clusters-magic numbers and platelets”, Computational Materials Science 35, 316-320, 2006;
J. Tamuliene, A. Tamulis, A. Ziriakoviene, A. Graja, “Quantum Mechanical Design of Two Logical Functions Molecular Device”, Lithuanian Journal of Physics, Vol. 46, No.2, p.p. 163-167, 2006;
Z. Rinkevicius, A. Tamulis, . Tamuliene, “β-Diketo Structure for Quantum information processing”, Lithuanian Journal of Physics, Vol. 46, No.4, p.p. 413-416, 2006;
J. Tamulienė, Ž. Rinkevičius, A. Tamulis, „Investigations of neutral radical molecules suitable for quantum information processing“,Lithuanian Journal of Physics Vol. 47, No2., p.p 137-142, 2007;
A.Kulbickas, J.Tamuliene, L.Rastenienė, M.Franskevicius, R.Vaisnoras, R.Martin-Rapun, M.Marcos, J. L.Serrano, B.Jaskorzynska: Optical study and structure modeling of the PPI dendrimer derivatives, Photonics and nanostructures-Fundamentals and Applications 5., p.p 178-183, 2007;
V. Balevičius, Z. Gdaniec, J. Tamulienė, H Fuess, NMR and quantum chemistry study of mesoscopic structuring in 3-methylpyridine/water/NaBr mixture in the vicinity of the phase separation boundary, Phase transitions. Vol. 81, iss. 4 , p. 293-301, 2008;
J. Tamulienė, R.Vaišnoras, G. Badenes, L.M. Balevičius, Magnetic Properties of Co6On (n=0–9,12) , Journal of nanomaterials , p. 308276-1-7, 2009;
J. Tamulienė, R. Vaišnoras, G. Badenes, M.L Balevičius, Stability and magnetic properties of Co2Om (m = 1,...,7) clusters, Lithuanian journal of physics. ISSN 1648-8504. Vol. 49, no. 2 , p. 137-143, 2009;
J. Tamuliene, M. Franckevicius, A. Kulbickas A, et al., Structure Modeling of Co-Encapsulated PPI Dendrimer, Journal of nanoscience and nanotechnology,Vol. 10, iss.10, p. 6407-6410, 2010;
V. Balevicius, Z. Gdaniec, K. Aidas, J. Tamuliene, NMR and Quantum Chemistry Study of Mesoscopic Effects in Ionic Liquids, Journal of Physical Chemistry A. Vol. 114, Iss. 16, p. 5365-537, 2010;
M. Franckevičius, J. Tamulienė, G. J. Babonas, I. Šimkienė, L. Rastenienė, A. Kulbickas, A. Iržikevičius, R. Vaišnoras , UV spectral features of poly(propylene imine) dendrimers, Lithuanian Physical Society, Lithuanian Academy of Science. Vilnius : Lietuvos mokslų akademijos leidykla, vol. 51, no. 3, p. 205-209, 2011;
J. Tamuliene, L.G. Romanova, V.S. Vukstich, A.V. Snegursky, Mechanism of the electron-impact-induced glycine fragmentation, Chemical Physics, 404, p.p. 36-44, 2012;
J. Tamuliene, L.G. Romanova, V.S. Vukstich, A.V. Snegursky, Mechanism of the electron-impact-induced methionine molecule fragmentation, Chemical Physics, 404, p.p. 74-81, 2012;
J. Tamuliene, L.G. Romanova, V.S. Vukstich, A.V. Snegursky, Electron –impact and thermal fragmentation of amino acid:Mechanisms and structure of the molecules, Nuclear Instruments and Methods in Physics Research B, 279, p.p. 128-134, 2012;
J. Tamulienė, L.G. Romanova, V.S. Vukstich, and A.V. Snegursky, Mechanism of the electron-induced alanine molecule fragmentation, Lith. J. Phys. 53, p.p. 195–209, 2013;
J. Tamuliene, L. G. Romanova, V. V. Vukstich, A.V. Papp and A. V. Snegursky, Electron-impact-induced asparagine molecule fragmentation, Eur. Phys. J. D (2014) 68: 118, DOI: 10.1140/epjd/e2014-50069-7;
J. Tamuliene, Electronic and Vibrational Spectra of C60 and Its Ions, Fullerenes, Nanotubes and Carbon Nanostructures (2014) 23, 187–195, DOI: 10.1080/1536383X.2014.926330;
J. Tamulienė, L.G. Romanova, V.S. Vukstich, and A.V. Snegursky and et al. Electron-impact-induced tryptophan molecule fragmentation , Eur. Phys. J. D (2015) 69: 1, DOI: 10.1140/epjd/e2014-50551-2;
L.G. Romanova, Jelena Tamulienė, Production of similar fragments from the glycine, alanine, and methionine amino acid molecules under low -energy electron impact, Acta physica Polonica. A, (2015) 128, p.p. 15-24;
J. Tamulienė, L. Romanova, V. Vukstich, A.Papp, S. Shkurin, L. Baliulytė, A. Snegursky, On the influence of low-energy ionizing radiation on the amino acid molecule: prolineThe European physical journal. D., 70, p.p. 143-153, 2016;
V. Skachkova, J. Tamulienė, V. Stempitsky, Usage of cobalt oxide particles as precursor for FEBID: Ab initio study, Journal of Nanoparticle Research, 18, p.p. 264-273, 2016;
Jonas Šarlauskas, Jelena Tamulienė, Narimantas Čėnas, Aziridinyl-substituted benzo-1,4-quinones: A preliminary investigation on the theoretical and experimental studies of their structure and spectroscopic properties, Spectrochimica acta. Part A: Molecular and Biomolecular Spectroscopy, 178, 136-141, 2017;
Jelena Tamuliene, Jonas Šarlauskas, Svajone Bekešiene, Modeling and investigation of new explosive materials based on N-(3,5-dimethyl-2,4,6-trinitrophenyl)-1H-1,2,4-triazol-3-amine, J Mol Model, 23:228, 2017. DOI 10.1007/s00894-017-3399-4;
Jelena Tamuliene, Julian Noll, Peter Frenzel, Tobias Rüffer, Alexander Jakob, Bernhard Walfort and Heinrich Lang, Synthesis of [{AgO ₂CCH ₂OMe(PPh ₃ )}_n ] and theoretical study of its use in focused electron beam induced deposition,Beilstein J. Nanotechnol. 2017, 8, 2615-2624. doi:10.3762/bjnano.8.262;
Jelena Tamuliene, Ab initio studies for silver precursor for FEBID: Ag(PMe3)n n=2,3,4, Materials physics and mechanics, (2018), 39 , 1, p.p.21-26. DOI: 10.18720/MPM.3912018_4;
J. Tamulienė, L. Romanova, V. Vukstich, A.Papp, L. Baliulytė, A. Snegursky, On the influence of low-energy ionizing radiation on the amino acid molecule: valine case, Lithuanian journal of physics (2018), 58 , 2 , p.p.135-148;
Laura Baliulytė; Jelena Tamulienė, On the influence of water on fragmentation of the amino acid L-threonine, Open physics, vol. 17, no. 1, 2019;
J. Tamulienė, L. Romanova, V. Vukstich, A.Papp, L. Baliulytė, A. Snegursky, The impact of low-energy ionizing radiation on glutamine, International Journal of Mass Spectrometry, 2019, 444:116185, DOI: 10.1016/j.ijms.2019.116185;
S. Masys; Z. Rinkevicius; J. Tamuliene, On the magnetic properties of nanodiamonds: electronic g-tensor calculations, J. Chem. Phys. 151, 044305 (2019); https://doi.org/10.1063/1.5111024;
S. Masys, Z. Rinkevicius, J. Tamuliene, Electronic g-tensors of nanodiamonds: Dependence on the size, shape, and surface functionalization, J. Chem. Phys. 151, 144305 (2019); https://doi.org/10.1063/1.5121849;
Šarūnas Masys; Žilvinas Rinkevičius; Jelena Tamulienė, Electronic g-tensors of nanodiamonds: dependence on the size, shape, and surface functionalization, Journal of Chemical Physics, vol. 151, iss. 14, 2020;
J. Tamulienė, L. Romanova, V. Vukstich, A. Snegursky, High-energy ionizing radiation influence on the fragmentation of glutamine, The European Physical Journal D volume 74, Article number: 13, 2020, https://doi.org/10.1140/epjd/e2019-100523-7;
Šarūnas Masys; Žilvinas Rinkevičius; Jelena Tamulienė, Computational study on the electronic g-tensors of hydrophilic and hydrophobic nanodiamonds interacting with water, Journal of Chemical Physics, Vol. 152, iss. 14,2020;
Andrea Preuß; Heinrich Lang; Jelena Tamulienė; Katarzyna Madajska; Iwona B. Szymanska; Marcus Korb; Tobias Rüffer; Janine Jeschke; Marcel Melzer; Jörn Bankwitz; Stefan E. Schulz, Ruthenium(II) MOCVD precursors for phosphorus‐doped ruthenium layer formation, European journal of inorganic chemistry, vol. 2020, no 17.;
Jelena Tamulienė; Alexander Snegursky; Liudmila Romanova; Vasyl Vukstich; Vasyl Rizak, Fragmentation of threonine under low-energy electron impact, The European physical journal. D., vol. 75, 2021;
Aušra Nemeikaitė-Čėnienė; Audronė Marozienė; Lina Misevičienė; Jelena Tamulienė; Aliaksei Yantsevich; Narimantas Čėnas, 5Flavoenzyme-catalyzed single-electron reduction of nitroaromatic antiandrogens: implications for their cytotoxicity, Free radical research, vol. 55, no. 3, 2021;
Jonas Šarlauskas; Jelena Tamulienė; Svajonė Bekešienė; Alexander Kravcov, Benzimidazole derivatives as energetic materials: a theoretical study, Materials, vol. 14, iss. 15, 2021;
Jelena Tamulienė; Liudmila Romanova; Vasyl Vukstich; Alexander Snegursky, Fragmentation of tyrosine by low-energy electron impact, European physical journal D, vol. 75, 2021.

Scopus and other Clarivate Analytics Web of Science publications

A. Tamulis, E.Stumbrys, V .Tamulis, JTamuliene, Quantum Mechanical Investigations of Photoactive Molecules, Supermolecules, Supramolecules and Design of Basic Elements Molecular Computers", NATO ASI series, 3. High Technology-Vol. 9, edited by F. Kajzar, V.M. Agranovich and C. Y.-C. Lee: "Photoactive Organic Materials: Science and Applications", Kluwer Academic Publishers, 1996, p.p. 53-66;
M. L. Balevicius, A. Tamulis, J. Tamuliene, J. M. Nunzi, " Study of Stilbene Molecule Trans-Cis Isomerization in First Excited State and Design of Molecular Random-Walkers", NATO ASI series, 3. High Technology-Vol. 79, Edited by F. Kajzar, V.M. Agranovich: "Multiphoton and Light Driven Multielectron Processes in Organics: New Phenomena, Materials and Applications", Kluwer Academic Publishers, 2000, p. p.437-450;
M. L. Balevicius, J. Tamuliene,A. Tamulis, A. Graja "Isomerization Pathways of Azobenzene'" NATO ARW book "Molecular Low Dimensional and Nanostructured Materials for Advanced Applications";
A. Tamulis, Z. Rinkevicius, V. Tamulis, J. Tamuliene, A. Graja, "Quantum Chemical Design of Logic Gates of Classical and Quantum Molecular Computers and Light Driven Molecular Logical Machines"accepted for publication in the Proceedings of the NATO ARW on Molecular Low Dimensional and Nanostructured Materials for Advanced Applications;
J. Tamuliene, A. Tamulis "Quantum Chemical Ab Initio Design of Molecular Electronic Tools For Biotechnologies" Biotech News International" Vol.6 No.5, 9-10/2001;
A. Tamulis, Z. Rinkevicius, J. Tamuliene, "Molecular Classical Computer Basic Elements", in "Decoherence and Implication in Quantum Computation and Information Transfer" edited by T. Gonis and P.E.A. Turchi, NATO Science Series III Computer and Systems Sciences, vol. 182, p.p. 358-365, 2001;
A. Tamulis, J. Tamuliene, V. Tamulis, A. Ziriakoviene, "Quantum Mechanical Design of Logic Elements of NMR and ESR Molecular Quantum Computers", accepted for publication in Nonlinear Optics & Quantum Optics (proceedings of NATO workshop, Bucharest June 2003);
J. Tamuliene, A.Tamulis, J.Kulys, "Electronic Structure of Dodecyl Syringate Radical Suitable for ESR Molecular Quantum Computers, "Nonlinear Analysis: Modelling and Control", vol. 9, No. 2, 2004, p.p. 185-196;
J. Tamuliene, M. L. Balevicius, A. Tamulis, V. Tamulis, "Charge Transfer in molecular Logical Device Possessing Different Molecular Bridges" in NATO Science Series, II. Mathematics, Physics and Chemistry, vol. 100, "Organic Nanophotonics", ed. by F. Charra, V. M. Agranovich, F. Kajzar, Kluwer Academic Publishers, 2003, p.p. 73-79, 2003;
A. Tamulis, J. Tamuliene, V. Tamulis, A. Graja, "Quantum Mechanical Design of Elements of Molecular Quantum Computers Based on Biliverdin and Aza-fullerene Compounds", in NATO Science Series, II. Mathematics, Physics and Chemistry, vol. 91, "Low-Dimensional Systems: Theory, Preparation, and Some Applications", ed. by L. M. Liz-Marzan and M. Giersing, Kluwer Academic Publishers, 2003, p.p. 267-280;
A. Tamulis, J. Tamuliene, V. Tamulis, "Quantum Mechanical Ab Initio Design of Elements of Molecular Quantum Computers", in NATO Science Series, II. Mathematics, Physics and Chemistry, vol. 96, "Molecular Electronics: Bio-sensors and Bio-computers", ed. by L. Barsanti, V. Evangelista, P. Gualtieri, V. Passarelli, S. Vestri, Kluwer Academic Publishers, 2003, p.p. 1-27;
A. Tamulis, J. Tamuliene, V. Tamulis, "Quantum Mechanical Design of Elements of Molecular Electronics and Quantum Computers", accepted for publications NATO Science Series "Molecular Electronics: Molecular Computers and Sensors", 2002;
A. Tamulis, J. Tamuliene, V. Tamulis ''Quantum Mechanical Design of Light Driven Molecular Logical Machines and Elements of Molecular Quantum Computers'' NATO ARW book ''Molecular Electronics: Bio-sensors and Bio-computers'' p 1-27. 2003, Kluwer Academic Publishers, ed. L.Barsanti et al.;
A. Tamulis, J. Tamuliene, V. Tamulis, A. Ziriakoviene, "Quantum Mechanical Design of Logic Elements of NMR and ESR Molecular Quantum Computers", Nonlinear Optics & Quantum Optics, Vol. 30, p.p. 285-300, 2003. ISSN: 1543-0537 (print) " (on-line ISSN TBA);
J. Tamulienė, R.Vaišnoras, M.-L. Balevičius, L. Rastinienė, „Geometrical structure of small Co nanoparticles“ Proceedings of SPIE -- Volume 6596, Advanced Optical Materials, Technologies, and Devices, Steponas Ašmontas, Jonas Gradauskas, Editors, 65961G , Jan. 25, 2007;
J. Tamulienė, R. Vaišnoras, G. Badenes, L.M. Balevičius, Co6Om (m=1 . 7) nanoparticles geometric and electronic structure changes within increasing of Oxygen number , Intelligent technologies in logistics and mechatronics systems ITELMS'2008 : proceedings of the 3rd international workshop, May 22-23, 2008, Panevėžys, Lithuania / Kaunas University of Technology Panevezys Institute, Warsaw Motor Transport Institute, Tallin University of Technology, Riga Technical University; edited by Ž. Bazaras, V. Kleiza. Kaunas : Technology, 2008. ISBN 9789955255314. p. 103-106. [Conference Proceedings Citation Index];
J. Tamulienė, R. Vaišnoras, G. Badenes, L.M. Balevičius, Investigation of optical properties of azo-dendrimers, Radiation interaction with material and its use in technologies : international conference : program and materials. p. 271-273;
J. Tamulienė, G. Badenes, R. Vaišnoras, L.M. Balevičius, Study of single structure of Con (n=6, 8, 10, 12, 14, 16, 18) nanoparticles Proceedings of SPIE. Vol. 7377 (2008), p. 737709;
J. Tamulienė, Quantum mechanical study on the fragmentation of the POPOP molecule. Accepted for publication in AIP proceedings.(2009);
S. Bekešienė, V. Kleiza, J. Tamulienė, Theoretical study on the molecular structures of nitrophenols and trinitrophenols, Intelligent technologies in logistics and mechatronics systems ITELMS'2008 : proceedings of the 3rd international workshop, May 22-23, 2008, Panevėžys, Lithuania / Kaunas University of Technology Panevezys Institute, Warsaw Motor Transport Institute, Tallin University of Technology, Riga Technical University; edited by Ž. Bazaras, V. Kleiza. Kaunas : Technology, 2008. p. 7-12;
M.L. Balevičius, J. Tamulienė, Jelena. Stability and optical properties of adenine and thymine pairs, Intelligent technologies in logistics and mechatronics systems : ITELMS’2009 : proceedings of the 4th international conference, June 04-05, 2009, Panevėžys, Lithuania. Kaunas : Technologija, 2009. ISBN 9789955257059. P. 49-51;
I.V. Chernyshova, J.E. Kontros, J. Tamulienė, L.M. Balevičius, Low-Energy Electron Collision with Gas-Phase Thymine Molecule. Radiation Interaction With Materials and Its Use in Technologies 2010. 3 rd. International Conference on Radiation Interaction With Materials and Its Use in Technologies, Kaunas 20-23 September 2010. ISSN 1822-508X;
J. Tamulienė, R. Vaišnoras, L.M. Balevičius, Use of Co Nanoparticles in the Hydrogen Fuel Production, Proceedings of 5th International Conference ITELMS’2010., International Conference on Intelligent Technologies in Logistics and Mechatronic Systems, Panevežys, 3-4 June 2010;
L. Baliulyte, J. Tamuliene, Asparagine monohidrate fragmentation. Ab initio study, Intelligent technologies in logistics and mechatronics systems : ITELMS’2013 : proceedings of the 8th international conference, May 23-24, 2013, Panevėžys, Lithuania. Kaunas : Technologija, 2013;
J. Tamuliene, V.S. Vukstich, L.G. Romanova, A.V. Papp, T.A. Snegurskaya, A.V. Snegursky, L. Baliulyte, On the influence of low- and high-energy ionizing radiation on the amino acid molecule properties: tryptophan. Radiation Interaction With Materials and Its Use in Technologies 2014. 5th International Conference on Radiation Interaction With Materials and Its Use in Technologies, May 12-15, 2014, Kaunas, Lithuania. ISSN 2351-583X;
J. Tamuliene, L. Baliulyte, Theoretical study of fragmentation of Co₆O₇ nanoparticle: ITELMS’2013 : proceedings of the 9th international conference, May 23-24, 2014, Panevėžys, Lithuania. Kaunas : Technologija, 2014;
J. Tamuliene, J. Sarlauskas, S. Bekesiene, V. Kleiza, Investigation of stability of N-(2,4,6-trinitrophenyl_-1H-1,2,4-triazol-3-amine, Intelligent technologies in logistics and mechatronics systems: ITELMS’2014 : proceedings of the 9th international conference, May 23-24, 2014, Panevėžys, Lithuania. Kaunas: Technologija, 2014. p.p.260-262;
Jelena Tamulienė, Maryia Zelenina, Ab initio studies of silver precursor for FEBID: Ag(1,1,1,5,5,5 hexafluoropentanedionato)(PMe3), Intelligent technologies in logistics and mechatronics systems, ITELMS'2015: proceedings of the 10th international conference, May 21-22, 2015, Panevezys, Lithuania / Edited by Z. Bazaras, V. Kleiza, p.p. 286-289, 2015;
J. Tamulienė, J. Šarlauskas, S. Bekešienė, Influence of substitutes to the stability and energetic properties of N-(2,4,6-trinitrophenyl)-1H-1,2,4-triazol-3-amine, ntelligent technologies in logistics and mechatronics systems, ITELMS'2015 : proceedings of the 10th international conference, May 21-22, 2015, Panevezys, Lithuania / Edited by Z. Bazaras, V. Kleiza, p. p. 266-269, 2015;
A.V. Papp, Jelena Tamulienė, L.G. Romanova, V.S. Vukstich, A.V. Snegursky, Fragmentation of tryptophan molecule by low-energy electron-impact, Journal of Physics: Conference Series, 635, 3, 2015;
J. Tamuliene, V. Barkaline, Structure and magnetic properties of Fe₆C₂ particles, Innovative Technologies and Management for Sustainability (ITMS’2016): proceedings of the 11th international conference, April 28-29, 2016, Panevezys, Lithuania / Edited by L. Koczy, D. Susniene, D. Zostautiene, p. p. 165-168, 2016;
J. Tamulienė, J. Šarlauskas, S. Bekešienė, Spectra of N-(2,4,6-trinitrophenyl)-1H-1,2,4-triazol-3-amine, Innovative Technologies and Management for Sustainability (ITMS’2016): proceedings of the 11th international conference, April 28-29, 2016, Panevezys, Lithuania / Edited by L. Koczy, D. Susniene, D. Zostautiene, p. p. 169-173, 2016;
Jonas Sarlauskas, Jelena Tamuliene, Aleksej M. Rodin, Ernestas Kuodis,New type Cu(N_3_)2 metal-azides for laser initiation, Proc. SPIE 11165, Optical Materials and Biomaterials in Security and Defence SystemsTechnology XVI, 111650C (16 October 2019); doi: 10.1117/12.2527664;
Aleksej Rodin; Jonas Šarlauskas; Jelena Tamulienė; Augustinas Petrulėnas, Detection of explosives by ultrasonic spectrum upon pulsed laser initiatio, Proceedings of SPIE, vol. 11542, 2020;
Jelena Tamulienė; Svajonė Bekešienė; Petr Kubeček, New approaches for security based on the properties of nanodiamonds, 11th International defense and homeland security simulation workshop; 18th International multidisciplinary modeling & simulation multiconference, 15-17 September 2021: virtual event.

Other publications

A. Tamulis, V. Tamulis and J. Tamuliene, "Quantum Mechanical Design of Molecular Implementation of Two, Three and Four Variable Logic Functions for Electronically Genome Regulation", Viva Origino, vol.26 (1998) 127-146;
J. Tamuliene, A. Tamulis, M. L. Balevicius, "Quantum Chemical investigations of Tetraphosphorus Activation using Ni(IV) Chloride and Bromide Complexes", Lithuanian Journal of Physics" ("Lietuvos Fizikos Zurnalas"), vol. 39, No 6, p.p. 463 - 468, 1999;
M. L. Balevicius, J. Tamuliene, A. Tamulis, "Trans-Cis Isomerization of Stilbene Molecule in First Excited State", Lithuanian Journal of Physics (Lietuvos Fizikos Zurnalas), vol. 39, No 6, p.p. 457 - 461, 1999;
M. L. Balevicius, J. Tamuliene,A. Tamulis, "Role of excited states on cis-trans isomerization of disperse orange -3 molecule" Lithuanian Journal of Physics (Lietuvos Fizikos Zurnalas).vol. 40,No. 6, 2000, p.p. 387-393;
M. L. Balevicius, J. Tamuliene, A. Tamulis "Influence of various substituents for isomerization processes of Azo-Dye", Lithuanian Journal of Physics (Lietuvos Fizikos Zurnalas).vol. 41,No. 2 2001, p.p. 83-88;
J. Tamuliene, Mindaugas L. Balevicius, Arvydas Tamulis, "Ab initio study of cuprate-mediate oxidative P-O coupling of white phosphorus and alcohols", Lithuanian Journal of Physics (Lietuvos Fizikos Zurnalas), vol. 42, No. 1, p.p 5-10, 2002;
A. Tamulis, J. Tamuliene, M. L. Balevicius, Z. Rinkevicius, " Ab initio Quantum Chemical Search of Per Linear Transition State of Azo-Dye Molecules and Design of Molecular Logical Machines", Nonlinear Optics, vol. 27, 2001, p.p 481-488;
A. Tamulis, Z. Rinkevicius, V. Tamulis, J. Tamuliene, S. P. Karna, C. M. Stickley," Ab Initio Quantum Chemical Design of Photoactive Molecular Logical Devices" Nonlinear Optics, vol. 27, 2001, p.p 385-393;
A. Makovska, J. Tamuliene, V. Balevicius, "Gamtamokslinių stebėjimų organizavimas pradinėje mokykloje" Gamtamokslinis ugdymas" 1(12), 2005;
J. Tamuliene, . L. Balevicius “Search of Sensitizer To Peptide Nucleic Acid Sequence with Adenine and Guanine Bases”, Viva Origino Vol.34, No. 3, 2006;
K. Paulikas, J. Tamulienė, R. Vaišnoras, G. Badenes, L.M. Balevičius,. Dendrimerų molekulių ertmių prigimties nustatymas naudojant GRID'Ą , Jaunųjų mokslininkų darbai. . 2008, Nr. 3 (19), p. 194-201. [CEEOL.; IndexCopernicus];
J. Tamulienė, G. Badenes, R. Vaišnoras, L.M. Balevičius, L. Rasteniene, Study of single of Con (n=6, 8, 10, 12) nanoparticles structure Nano-design, technology, computer simulations (NDTCS '08) : 12th international workshop on new approaches to high-tech : June 23-27, 2008, Minsk, Belarus. Minsk, 2008. p. 40-44;
J. Tamulienė, R. Vaišnoras, G. Badenes, L.M. Balevičius, Point of view on magnetic properties of Con ( n=6,8,10,12) based on quantum chemistry investigations , Proceedings of thirteenth international workshop on new approaches to high-tech: nano-design, technology, computer simulations- NDTCS’09 [Elektroninis išteklius] : 22-26 June 2009, Vilnius, Lithuania Vilnius : Institute of Theoretical Physics and Astronomy of Vilnius University, 2009. p. 126-133;
J. Tamulienė, R. Vaišnoras, G. Badenes, L.M. Balevičius, Point of View on Magnetic Properties of Con (n=6,8,10,12) Based on Quantum Chemistry Investigations. Materials Physics and Mechanics 2010, vol. 9, no. 1. ISSN 1605-8119 p. 35-41;
A. Šliogeris, V. Astachov, J. Tamulienė, R. Vaišnoras, L.M. Balevičius, Glikodendrimerų funkcionalizuotų triptofano ir dansilo molekulėmis optinių savybių tyrimas. Jaunųjų mokslininkų darbai / Šiaulių universitetas. 2010, nr. 1. p. 261-265;
A. Šliogeris, J. Tamulienė, R. Vaišnoras. Quantum mechanical investigations on structure and stability of the smallest diamondoids with defects, Materials physics and mechanics. St. Petersburg : Institute of Problems of Mechanical Engineering. 2011, vol. 12, no. 2, p. 186-194;
A. Juozapavicius, J.Tamuliene, V.Tomkus, S.Lapienis. GRID computing for the space technology research, Space Research Review, 1, 213-219 (2012);
O. Kozlova, J. Tamuliene, Modeling and investigations of the heterofullerenes C₅₉X (X=Na, Li, Mg, Be), Materials Physics and Mechanics 18 (2013) 63-69;
T. Breczko, J. Tamuliene, Investigation of electronic properties of Ni2MnGa, and Co2MnGa Heusler alloys, Materials Physics and Mechanics 20 (2014) 37-43;
Jelena Tamulienė, Jonas Šarlauskas, Svajonė Bekešienė, Influence of nitro group substitutes to the stability and energetic properties of N-(2,4,6-trinitrophenyl)-1H- 1,2,4-triazol-3-amine, American journal of analytical chemistry, 8, 2, 125-141, 2017;
Jonas Šarlauskas; Justas Vaitekūnas; Jelena Tamulienė, Energetic polynitrophenyl substituted 1,2,4-triazole derivatives: synthesis, properties and LC-MS analysis, New trends in research of energetic materials : proceedings of the 21st seminar, Pardubice, Czech Republic, April 18-20, 2018;
T. Breczko, J. Tamuliene, V.Barkaline Investigation of Geometric and Electronic Structures of Heusler Alloys: Cubic and Tetragonal Lattices, EPH - International Journal of Applied Science, 6, Issue-3, 2020. https://ephjournal.org/index.php/as/article/view/1663/970;
Aleksej Rodin; Jonas Sarlauskas; Jelena Tamuliene; Paulius Mackonis, Recognition of energetic materials by ultrasonic spectrum upon pulsed laser initiation, Proceedings of 14th Pacific Rim Conference on Lasers and Electro-Optics (CLEO PR 2020) : 3–5 August 2020, Sydney, Australia.

Books and chapter of books

A. Tamulis, J. Tamuliene, V. Tamulis, "Quantum Mechanical Design of Photoactive Molecular Machines andLogical Devices", to be published by American Scientific Publishers in "Handbook on Photochemistry and Photobiology", 2002;
J. Tamuliene, R. Vaisnoras, G. Badenes, M.L. Balevicius“ View on the Magnetic Properties of Nanoparticles Com (m=6, 8, 10, 12, 14) and Co6On (n = 1-9), ch.21, InTech, 2012 chapter of book:“Smart Nanoparticles Technology” edited by Abbass Hashim, ISBN 978-953-51-0500-8, Hard cover, 576 pages, Publisher: InTech, Published: April 18, 2012 under CC BY 3.0 license, in subject Nanotechnology and Nanomaterials, DOI: 10.5772/1969;
A.V. Snegursky, J. Tamuliene, V.S. Vukstich and L.G. Romanova “Methionine Molecule Electron-Impact-Induced Fragmentation: Mechanisms and Chemical Structure”, ch.7, Nova Publisher, 2013, chapter of book: “Methionine: Biosynthesis, Chemical Structure and Toxity” edited by Alexander Snegursky, 978-1-62618-246-2, Hard cover, 197 pages, Publisher: Nova, Published: April, 2013;
A.V. Snegursky, J. Tamuliene, L.G. Romanova, V.S. Vukstich “Amino Acid Molecules Fragmentation by Low-Energy Electrons’, Nova Publisher, 2014, ISBN:978-1-63117-449-0, 99 pages;
A.V. Snegursky, J. Tamulienė, L.G. Romanova, V.S. Vukstich, A.V. Papp, Tryptophan molecule fragmentation in collisions with low-energy electrons, New dewelopments intrypthophan research / Editors: Victoria Hayes, Nova science publishers, 2015, p.p. 105-142;
Jelena Tamulienė; Liudmila Romanova; Vukstich Vasyl; Alexander Snegursky, High-energy electron impact influence on the amino acid fragmentation, Horizons in world physics. Vol. 305 / Albert Reimer (Editor), 2021.

About myself

Education and training:
2012, Master of Business economy, Vilnius University;
2005-2010, Bachelor of Business management, Vilnius Gediminas Technical University;
1994-2000, PhD of Quantum chemistry, Institute of Theoretical Physics and Astronomy of Vilnius University;
1993-1994, Master degree of Quantum chemistry, Vilnius Pedagogical University;
1986-1992, Teacher of Physics and Astronomy, Physics, Vilnius Pedagogical University.

Work experience:
2004 till now, Senior research fellow, Institute of Theoretical Physics and Astronomy, Vilnius, Lithuania.
Modelling and investigation of new materials with important electrical and optical properties by using quantum mechanical approach. Predicting and investigation chemical reactions, possible processes necessary to create a final product. Participation in confernces, publishing scientific papers.

2010 till now, Lecturer, Faculty of Mathematics and Informatics, Vilnius University.
Teach and supervise graduate and undegraduate students. Update, design and develop modules. Maintain and develop teaching materials. Develop new programmes, innovative teaching approach.

2012-07-10 till 2012-10-01, Application Expert, EGI.eu, The Netherlands.
Assist EGI with reviewing existing applications provided by EGI members from the 'Computational Chemistry and Material Sciences' domain, identifying key scientific applications that could benefit from resources and services of the National Grid Infrastructures, and assist the integration of these applications into EGI through the setup of focused technical project.

2003, PhD position, Technical University of Dresden, Institute of Physical Chemistry and Electrochemistry, Dresden, Germany.
Quantum mechanical investigations of endohedral fullerenes and molybdenum sulphides nanoparticles.

2000-2002, Researcher, Institute of Theoretical Physics and Astronomy, Vilnius, Lithuania.
Quantum mechanical investigations of photoactive molecules and design of molecular devices. Investigations of the catalytic activation of tetrahedral phosphorus by transition metal applying quantum mechanical ab initio methods.

1991-2003, Vilnius Zirmunu gymnazium, Vilnius, Lithuania.
Teaching of Physics.

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