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  • Alexander Chroneos
2016

Vacancy formation in MoO3: hybrid density functional theory and photoemission experiments

Akande, S. O., Chroneos, A., Vasilopoulou, M., Kennou, S. & Schwingenschlögl, U., 29 Sep 2016, In : Journal of Materials Chemistry C Materials for optical, magnetic and electronic devices. 4, 40, p. 9526-9531 6 p.

Research output: Contribution to journalArticle

Open Access
File
8 Citations (Scopus)
20 Downloads (Pure)

Electrophysical properties of nanoporous cerium dioxide–water system

Biletskyi, V. I., Bogdanov, V. V., Boyko, Y. I., Vovk, R. V., Khadzhai, G. Y., Goulatis, I. L. & Chroneos, A., 7 Oct 2016, In : Journal of Materials Science: Materials in Electronics. p. 1-3

Research output: Contribution to journalArticle

Open Access
File
12 Downloads (Pure)
2019

Defects, Lithium Ion Diffusion and Trivalent Dopants in Li2MnO2

Kuganathan, N., Ganeshalingam, S., Abiman, P. & Chroneos, A., 18 Feb 2019, In : Journal of Jaffna Science Association. 1, 1

Research output: Contribution to journalArticle

3 Downloads (Pure)
2016

Effect of longitudinal magnetic field on the excess conductivity of monodomain YBa2Cu3O7-δ single crystals

Tiutierieva, K. V., Zavgorodnya, N. M., Dovgopolova, Y. V., Chernovol-Tkachenko, O. O., Vovk, R. V. & Chroneos, A., 2016, In : Functional Materials. 23, 2, p. 170-173

Research output: Contribution to journalArticle

Open Access
2019

The Ci(SiI)n defect in neutron‑irradiated silicon

Londos, C. A., Christopoulos, S., Chroneos, A., Angeletos, T., Potsidi, M. & Antonaras, G., 30 Nov 2019, In : Journal of Materials Science: Materials in Electronics. (In-Press), p. (In-Press) 5 p.

Research output: Contribution to journalArticle

2017

Diffusion in energy materials: Governing dynamics from atomistic modelling

Parfitt, D., Kordatos, A., Filippatos, P. P. & Chroneos, A., Sep 2017, In : Applied Physics Reviews. 4, 3, 031305.

Research output: Contribution to journalBook/Film/Article review

2 Citations (Scopus)
2019

Dinitrogen activation by zirconium dimer loaded C60

Kuganathan, N., Fossati, P. C. M., Gkanas, E. & Chroneos, A., 31 May 2019, In : AIP Advances. 9, 5, 9 p., 055331.

Research output: Contribution to journalArticle

Open Access
File
2 Downloads (Pure)
2018

Reactor pressure vessel embrittlement: Insights from neural network modelling

Mathew, J., Parfitt, D., Wilford, K., Riddle, N., Alamaniotis, M., Chroneos, A. & Fitzpatrick, M. E., 15 Apr 2018, In : Journal of Nuclear Materials. 502, p. 311-322 12 p.

Research output: Contribution to journalArticle

Open Access
File
5 Citations (Scopus)
18 Downloads (Pure)
2019

Engineering Transport in Manganites by Tuning Local Non-Stoichiometry in Grain Boundaries

Chiabrera, F., Garbayo, I., López‐Conesa, L., Martín, G., Ruiz‐Caridad, A., Walls, M., Ruiz‐González, L., Kordatos, A., Núñez, M., Morata, A., Estradé, S., Chroneos, A., Peiró, F. & Tarancón, A., 25 Jan 2019, In : Advanced Materials. 31, 4, 8 p., 1805360.

Research output: Contribution to journalArticle

Open Access
File
4 Citations (Scopus)
1 Downloads (Pure)
2016

Gold and silver diffusion in germanium: a thermodynamic approach

Panayiotatos, Y., Vovk, R. V. & Chroneos, A., 1 Oct 2016, In : Journal of Materials Science: Materials in Electronics. (in press)

Research output: Contribution to journalArticle

Open Access
File
3 Citations (Scopus)
27 Downloads (Pure)

Modification by high pressure of fluctuation paraconductivity of underdoped HoBa2Cu3O7-δ single crystals

Kamchatnaya, S. N., Goulatis, I. L., Vovk, R. V. & Chroneos, A., Aug 2016, In : Journal of Materials Science: Materials in Electronics. 27, 8, p. 8013-8019

Research output: Contribution to journalArticle

Open Access
File
1 Citation (Scopus)
23 Downloads (Pure)
2018
Open Access
File
22 Citations (Scopus)
106 Downloads (Pure)
2019

312 MAX phases: Nuclear applications of M3AlC2

Christopoulos, S., Parfitt, D., Kelaidis, N., Fitzpatrick, M. & Chroneos, A., 4 Jul 2019.

Research output: Contribution to conferencePoster

2016

Stabilization of Zrn+1AlCn MAX Phases: Issues and Achievements

Zapata-Solvas, E., Christopoulos, S., Fitzpatrick, M., Chroneos, A. & Lee, W. E., 23 Oct 2016.

Research output: Contribution to conferenceAbstract

Open Access
2017
Open Access
File
33 Citations (Scopus)
328 Downloads (Pure)
2016

Thermodynamic calculations of oxygen self-diffusion in mixed-oxide nuclear fuels

Parfitt, D. C., Cooper, M. W. D., Rushton, M. J. D., Christopoulos, S-R. G., Fitzpatrick, M. E. & Chroneos, A., 29 Jul 2016, In : RSC Advances. 6, p. 74018-74027 10 p.

Research output: Contribution to journalArticle

Open Access
File
8 Citations (Scopus)
23 Downloads (Pure)
2017

Synthesis and physical properties of (Zr1−x,Tix)3AlC2MAX phases

Zapata-Solvas, E., Hadi, M., Horlait, D., Parfitt, D., Thibaud, A., Chroneos, A. & Lee, W., Aug 2017, In : Journal of the American Ceramic Society. 100, 8, p. 3393-3401 9 p.

Research output: Contribution to journalArticle

Open Access
File
24 Citations (Scopus)
15 Downloads (Pure)
2019

Diffusion and Dopant Activation in Germanium: Insights from Recent Experimental and Theoretical Results

Sgourou, E. N., Panayiotatos, Y., Vovk, R. V., Kuganathan, N. & Chroneos, A., 15 Jun 2019, In : Applied Sciences. 9, 12, 14 p., 2454.

Research output: Contribution to journalReview article

Open Access
File
3 Citations (Scopus)
5 Downloads (Pure)
2016

Attempts to synthesise quaternary MAX phases (Zr,M)2AlC and Zr2(Al,A)C as a way to approach Zr2AlC

Horlait, D., Grasso, S., Chroneos, A. & Lee, W. E., 9 Feb 2016, In : Materials Research Letters. 4, 3, p. 137-144

Research output: Contribution to journalArticle

Open Access
File
37 Citations (Scopus)
20 Downloads (Pure)

Plasma engineering of graphene

Dey, A., Chroneos, A., Braithwaite, N. S. J., Gandhiraman, R. P. & Krishnamurthy, S., 22 Apr 2016, In : Applied Physics Reviews. 3, 021301.

Research output: Contribution to journalArticle

Open Access
File
59 Citations (Scopus)
216 Downloads (Pure)
2019

Defects, dopants and Mg diffusion in MgTiO3

Kuganathan, N., Iyngaran, P., Vovk, R. & Chroneos, A., 13 Mar 2019, In : Scientific Reports. 9, 1, 9 p., 4394.

Research output: Contribution to journalArticle

Open Access
File
10 Citations (Scopus)
10 Downloads (Pure)
2018

Defects, Dopants and Sodium Mobility in Na2MnSiO4

Kuganathan, N. & Chroneos, A., 1 Dec 2018, In : Scientific Reports. 8, 1, 7 p., 14669.

Research output: Contribution to journalArticle

Open Access
File
18 Citations (Scopus)
7 Downloads (Pure)

Lithium diffusion in Li5FeO4

Kuganathan, N., Iyngaran, P. & Chroneos, A., 11 Apr 2018, In : Scientific Reports. 8, 1, 7 p., 5832.

Research output: Contribution to journalArticle

Open Access
File
18 Citations (Scopus)
9 Downloads (Pure)
2020

Defects and Dopants in CaFeSi2O6: classical and DFT simulations

Kuganathan, N. & Chroneos, A., 10 Mar 2020, In : Energies. 13, 5, 16 p., 1285.

Research output: Contribution to journalArticle

Open Access
File
2 Downloads (Pure)
2019

Encapsulation of heavy metals by a nanoporous complex oxide 12CaO · 7Al2 O3

Kuganathan, N., Grimes, R. W. & Chroneos, A., 23 Apr 2019, In : Journal of Applied Physics. 125, 16, 9 p., 165103.

Research output: Contribution to journalArticle

2 Citations (Scopus)
2018

Li2SnO3 as a Cathode Material for Lithium-ion Batteries: Defects, Lithium Ion Diffusion and Dopants

Kuganathan, N., Kordatos, A. & Chroneos, A., 22 Aug 2018, In : Scientific Reports. 8, 1, 9 p., 12621.

Research output: Contribution to journalArticle

Open Access
File
14 Citations (Scopus)
28 Downloads (Pure)
2019

Defect process, dopant behaviour and Li ion mobility in the Li 2 MnO 3 cathode material

Kuganathan, N., Sgourou, E. N., Panayiotatos, Y. & Chroneos, A., 7 Apr 2019, In : Energies. 12, 7, 11 p., 1329.

Research output: Contribution to journalArticle

Open Access
File
8 Citations (Scopus)
8 Downloads (Pure)

Mg6MnO8 as a Magnesium-Ion Battery Material: Defects, Dopants and Mg-Ion Transport

Kuganathan, N., Gkanas, E. & Chroneos, A., 21 Aug 2019, In : Energies. 12, 17, 9 p., 3213.

Research output: Contribution to journalArticle

Open Access
File
3 Citations (Scopus)
25 Downloads (Pure)
2018

Intrinsic defect processes and elastic properties of Ti3AC2 (A = Al, Si, Ga, Ge, In, Sn) MAX phases

Christopoulos, S., Filippatos, P-P., Hadi, M. A., Kelaidis, N., Fitzpatrick, M. & Chroneos, A., 14 Jan 2018, In : Journal of Applied Physics. 123, 2, 025103.

Research output: Contribution to journalArticle

Open Access
File
9 Citations (Scopus)
42 Downloads (Pure)

Probabilistic kernel machines for predictive monitoring of weld residual stress in energy systems

Alamaniotis, M., Mathew, J., Chroneos, A., Fitzpatrick, M. & Tsoukolas, L., May 2018, In : Engineering Applications of Artificial Intelligence. 71, p. 138-154 16 p.

Research output: Contribution to journalArticle

Open Access
File
4 Citations (Scopus)
20 Downloads (Pure)
2017

Defect processes of M3AlC2 (M = V, Zr, Ta, Ti) MAX phases

Christopoulos, S., Kelaidis, N. & Chroneos, A., Aug 2017, In : Solid State Communications. 261, p. 54-56 3 p.

Research output: Contribution to journalArticle

Open Access
File
3 Citations (Scopus)
24 Downloads (Pure)
2016

Conductivity of YBCO ceramics in a wide range of temperatures and hafnium impurities concentrations

Savich, S. V., Samoilov, A. V., Samsonik, A. L., Sukhov, V. N., Tiutierieva, K. V., Rusalovich, A. I., Vovk, R. V., Boynik, A. B. & Chroneos, A., 2016, In : Functional Materials. 23, 1, p. 21-26

Research output: Contribution to journalArticle

Open Access
2020

Lithium Storage in Nanoporous Complex Oxide 12CaO•7Al2O3 (C12A7)

Kuganathan, N. & Chroneos, A., 26 Mar 2020, In : Energies. 13, 7, 9 p., 1457.

Research output: Contribution to journalArticle

Open Access
File

Computer modeling investigation of MgV2O4 for Mg-ion batteries

Kuganathan, N., Davazoglou, K. & Chroneos, A., 17 Jan 2020, In : Journal of Applied Physics. 127, 3, 10 p., 035106.

Research output: Contribution to journalArticle

2016

Physical properties of the recently discovered Zr2(Al1−x Bi x )C MAX phases

Hadi, M. A., Vovk, R. V. & Chroneos, A., Nov 2016, In : Journal of Materials Science: Materials in Electronics. 27, 11, p. 11925-11933 9 p.

Research output: Contribution to journalArticle

Open Access
File
27 Citations (Scopus)
9 Downloads (Pure)
2017

Impact of isovalent doping on the formation of the CiOi(SiI)n defects in silicon

Christopoulos, S., Sgourou, E. N., Vovk, R. V., Chroneos, A. & Londos, C. A., Sep 2017, In : Solid State Communications. 263, p. 19-22 4 p.

Research output: Contribution to journalArticle

Open Access
File
5 Citations (Scopus)
12 Downloads (Pure)
2018

Migration of sodium and lithium interstitials in anatase TiO2

Kordatos, A., Kelaidis, N. & Chroneos, A., 1 Feb 2018, In : Solid State Ionics. 315, p. 40-43 4 p.

Research output: Contribution to journalArticle

Open Access
File
3 Citations (Scopus)
24 Downloads (Pure)

Defects and lithium migration in Li2CuO2

Kordatos, A., Kuganathan, N., Kelaidis, N., Iyngaran, P. & Chroneos, A., 30 Apr 2018, In : Scientific Reports. 8, 1, 6754.

Research output: Contribution to journalArticle

Open Access
File
21 Citations (Scopus)
21 Downloads (Pure)
2017

Grain Boundary Diffusion in Fluorite Structured Oxides

Christopoulos, S., Parfitt, D., Fossati, P., Kelaidis, N. & Chroneos, A., Sep 2017.

Research output: Contribution to conferencePoster

2016

A thermodynamic approach to self-diffusion in silicon: Evidence of a single diffusion mechanism?

Saltas, V., Chroneos, A. & Vallianatos, F., 15 Sep 2016, In : Materials Chemistry and Physics. 181, p. 204-208

Research output: Contribution to journalArticle

15 Citations (Scopus)
2019
Open Access
File
10 Downloads (Pure)

Encapsulation of cadmium telluride nanocrystals within single walled carbon nanotubes

Kuganathan, N. & Chroneos, A., 24 Mar 2019, In : Inorganica Chimica Acta. 488, p. 246-254 9 p.

Research output: Contribution to journalArticle

Open Access
File
2 Citations (Scopus)
2 Downloads (Pure)

Atomistic Simulations of the Defect Chemistry and Self-Diffusion of Li-ion in LiAlO2

Kuganathan, N., Dark, J., Sgourou, E. N., Panayiotatos, Y. & Chroneos, A., 27 Jul 2019, In : Energies. 12, 15, 10 p., 2895.

Research output: Contribution to journalArticle

Open Access
File
3 Citations (Scopus)
6 Downloads (Pure)

Electronic structures, bonding natures and defect processes in Sn-based 211 MAX phases

Hadi, M. A., Kelaidis, N., Naqib, S. H., Chroneos, A. & Islam, A. K. M. A., Oct 2019, In : Computational Materials Science. 168, p. 203-212 10 p.

Research output: Contribution to journalArticle

2 Citations (Scopus)

Na3V(PO4)2 cathode material for Na ion batteries: Defects, dopants and Na diffusion

Kuganathan, N. & Chroneos, A., Aug 2019, In : Solid State Ionics. 336, p. 75-79 5 p.

Research output: Contribution to journalArticle

8 Citations (Scopus)

Defect Chemistry and Li-ion Diffusion in Li2RuO3

Kuganathan, N., Kordatos, A. & Chroneos, A., 24 Jan 2019, In : Scientific Reports. 9, 1, 9 p., 550.

Research output: Contribution to journalArticle

Open Access
File
13 Citations (Scopus)
18 Downloads (Pure)
2016

S-functionalized MXenes as electrode materials for Li-ion batteries

Zhu, J., Chroneos, A., Eppinger, J. & Schwingenschlögl, U., Dec 2016, In : Applied Materials Today. 5, p. 19-24 6 p.

Research output: Contribution to journalArticle

Open Access
File
25 Citations (Scopus)
194 Downloads (Pure)
2020

Encapsulation and substitution of Fe in C12A7 (12CaO⋅ 7Al2O3)

Kuganathan, N., Gkanas, E. & Chroneos, A., 27 Jan 2020, In : AIP Advances. 10, 1, 7 p., 015242.

Research output: Contribution to journalArticle

Open Access
File
1 Downloads (Pure)
2016

Investigation of oxygen self-diffusion in PuO2 by combining molecular dynamics with thermodynamic calculations

Saltas, V., Chroneos, A., Cooper, M. W. D., Fitzpatrick, M. E. & Vallianatos, F., 26 Oct 2016, In : RSC Advances. 6, 105, p. 103641-103649 9 p.

Research output: Contribution to journalArticle

Open Access
File
5 Citations (Scopus)
17 Downloads (Pure)