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  • Alexander Chroneos
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
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3 Citations (Scopus)
28 Downloads (Pure)
2020

Electronegativity and doping in Si1-xGex alloys

Christopoulos, S., Kuganathan, N. & Chroneos, A., 4 May 2020, In : Scientific Reports. 10, 11 p., 7459.

Research output: Contribution to journalArticle

Open Access
File
5 Downloads (Pure)
2018

Defects, Dopants and Lithium Mobility in Li 9 v 3 (P 2 O 7 ) 3 (PO 4 ) 2

Kuganathan, N., Ganeshalingam, S. & Chroneos, A., 25 May 2018, In : Scientific Reports. 8, 1, 8140.

Research output: Contribution to journalArticle

Open Access
File
18 Citations (Scopus)
14 Downloads (Pure)
2017

Mechanical behavior, bonding nature and defect processes of Mo2ScAlC2: A new ordered MAX phase

Hadi, M. A., Naqib, S. H., Christopoulos, S., Chroneos, A. & Islam, A. K. M. A., 15 Nov 2017, In : Journal of Alloys and Compounds. 724, p. 1167-1175 9 p.

Research output: Contribution to journalArticle

Open Access
File
20 Citations (Scopus)
13 Downloads (Pure)
2019

Defects, dopants and Li-ion diffusion in Li2SiO3

Kuganathan, N., Tsoukalas, L. H. & Chroneos, A., 1 Jul 2019, In : Solid State Ionics. 335, p. 61-66 6 p.

Research output: Contribution to journalArticle

Open Access
File
15 Citations (Scopus)
3 Downloads (Pure)
2017

Defect processes in Li2ZrO3: insights from atomistic modelling

Kordatos, A., Christopoulos, S-R. G., Kelaidis, N. & Chroneos, A., 26 Apr 2017, In : Journal of Materials Science: Materials in Electronics. (in press), p. (in press) 5 p.

Research output: Contribution to journalArticle

Open Access
File
3 Citations (Scopus)
65 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
4 Citations (Scopus)
32 Downloads (Pure)
2016

Infrared studies of the evolution of the CiOi(SiI) defect in irradiated Si upon isothermal anneals

Angeletos, T., Chroneos, A. & Londos, C. A., 31 Mar 2016, In : Journal of Applied Physics. 119, 125704.

Research output: Contribution to journalArticle

Open Access
File
6 Citations (Scopus)
29 Downloads (Pure)
2019

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

Open Access
File
3 Citations (Scopus)
1 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
28 Citations (Scopus)
221 Downloads (Pure)
2018

Defect pair formation in fluorine and nitrogen codoped TiO2

Kordatos, A., Kelaidis, N. & Chroneos, A., 28 Apr 2018, In : Journal of Applied Physics. 123, 16, 161510.

Research output: Contribution to journalArticle

Open Access
File
2 Citations (Scopus)
29 Downloads (Pure)
2017

Hydrogen and nitrogen codoping of anatase TiO2 for efficiency enhancement in organic solar cells

Vasilopoulou, M., Kelaidis, N., Polydorou, E., Soultati, A., Davazoglou, D., Argitis, P., Papadimitropoulos, G., Tsikritzis, D., Kennou, S., Auras, F., Georgiadou, D. G., Christopoulos, S. R. G. & Chroneos, A., 2017, In : Scientific Reports. 7, 1, 17839.

Research output: Contribution to journalArticle

Open Access
File
9 Citations (Scopus)
15 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

Open Access
File
3 Citations (Scopus)
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
6 Citations (Scopus)
12 Downloads (Pure)
2019

A Computational Study of Defects, Li-Ion Migration and Dopants in Li2ZnSiO4 Polymorphs

Perera, D., Ganeshalingam, S., Kuganathan, N. & Chroneos, A., 27 Oct 2019, In : Crystals. 9, 11, 13 p., 563.

Research output: Contribution to journalArticle

Open Access
File
1 Citation (Scopus)
2 Downloads (Pure)

Technetium Encapsulation by A Nanoporous Complex Oxide 12CaO•7Al2O3 (C12A7)

Kuganathan, N. & Chroneos, A., 30 May 2019, In : Nanomaterials. 9, 6, 12 p., 816.

Research output: Contribution to journalArticle

Open Access
File
4 Citations (Scopus)
7 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)
7 Downloads (Pure)
Open Access
File
11 Downloads (Pure)
2016

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
64 Citations (Scopus)
253 Downloads (Pure)
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
3 Downloads (Pure)
2017

M3AlC2 MAX phases for nuclear applications

Christopoulos, S., Fitzpatrick, M. & Chroneos, A., 6 Sep 2017.

Research output: Contribution to conferenceAbstract

2018

Defect process and lithium diffusion in Li2TiO3

Kuganathan, N., Kordatos, A., Fitzpatrick, M. E., Vovk, R. V. & Chroneos, A., 1 Dec 2018, In : Solid State Ionics. 327, p. 93-98 6 p.

Research output: Contribution to journalArticle

19 Citations (Scopus)
2017
Open Access
File
24 Citations (Scopus)
51 Downloads (Pure)
2016

Disordered Ionic Conductors

Kordatos, A., Christopoulos, S., Fitzpatrick, M. & Chroneos, A., 8 Sep 2016.

Research output: Contribution to conferenceAbstract

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
10 Citations (Scopus)
27 Downloads (Pure)
Open Access
File
3 Citations (Scopus)
24 Downloads (Pure)
2020

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

2019

Mechanical behaviors, lattice thermal conductivity and vibrational properties of a new MAX phase Lu2SnC

Hadi, M. A., Kelaidis, N., Naqib, S. H., Chroneos, A. & Islam, A. K. M. A., Jun 2019, In : Journal of Physics and Chemistry of Solids. 129, p. 162-171 10 p.

Research output: Contribution to journalArticle

10 Citations (Scopus)

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
4 Citations (Scopus)
6 Downloads (Pure)

The encapsulation selectivity for anionic fission products imparted by an electride

Kuganathan, N., Chroneos, A. & Grimes, R. W., 20 Sep 2019, In : Scientific Reports. 9, 1, 11 p., 13612.

Research output: Contribution to journalArticle

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

Relative concentrations of carbon related defects in silicon

Christopoulos, S., Parfitt, D., Sgourou, E. N., Londos, C. A., Vovk, R. V. & Chroneos, A., Nov 2016, In : Journal of Materials Science: Materials in Electronics. 27, 11, p. 11268–11272 5 p.

Research output: Contribution to journalArticle

2019

Defects, Diffusion, and Dopants in Li2Ti6O13: Atomistic Simulation Study

Kuganathan, N., Ganeshalingam, S. & Chroneos, A., 4 Sep 2019, In : Materials. 12, 18, p. 1-11 11 p., 2851.

Research output: Contribution to journalArticle

Open Access
File
2 Citations (Scopus)
24 Downloads (Pure)
2017

The CiOi(SiI)2 defect in silicon: Density functional theory calculations

Christopoulos, S. R. G., Sgourou, E. N., Angeletos, T., Vovk, R. V., Chroneos, A. & Londos, C. A., Jul 2017, In : Journal of Materials Science: Materials in Electronics. 28, 14, p. 10295-10297 3 p.

Research output: Contribution to journalArticle

Open Access
File
6 Citations (Scopus)
18 Downloads (Pure)
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
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3 Downloads (Pure)
2020

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

Londos, C. A., Christopoulos, S., Chroneos, A., Angeletos, T., Potsidi, M. & Antonaras, G., Jan 2020, In : Journal of Materials Science: Materials in Electronics. 31, 2, p. 930-934 5 p.

Research output: Contribution to journalArticle

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)
30 Downloads (Pure)
2019

Defects and dopant properties of Li3V2(PO4)3

Kuganathan, N. & Chroneos, A., 23 Jan 2019, In : Scientific Reports. 9, 1, 8 p., 333.

Research output: Contribution to journalArticle

Open Access
File
17 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
4 Citations (Scopus)
27 Downloads (Pure)
2016

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

Theoretical Modeling of Defects, Dopants, and Diffusion in the Mineral Ilmenite

Kuganathan, N., Srikaran, R., Fossati, P. C. M. & Chroneos, A., 4 Oct 2019, In : Minerals. 9, 10, 13 p., 610.

Research output: Contribution to journalArticle

Open Access
File
7 Downloads (Pure)
2018
Open Access
File
26 Citations (Scopus)
117 Downloads (Pure)
2019

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

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

Silicene/germanene on MgX2 (X = Cl, Br, and I) for Li-ion battery applications

Zhu, J., Chroneos, A. & Schwingenschlögl, U., Mar 2016, In : Nanoscale. 8, p. 7272-7277 6 p.

Research output: Contribution to journalArticle

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

Controlling A-center concentration in silicon through isovalent doping: Mass action analysis

Christopoulos, S., Parfitt, D. C., Sgourou, E. N., Londos, C. A., Vovk, R. V. & Chroneos, A., 29 Jan 2016, In : Journal of Materials Science: Materials in Electronics. 27, 5, p. 4385-4391

Research output: Contribution to journalArticle

Open Access
File
2 Citations (Scopus)
33 Downloads (Pure)
2019

Defects, Lithium Mobility and Tetravalent Dopants in the Li3NbO4 Cathode Material

Kuganathan, N., Kordatos, A., Kelaidis, N. & Chroneos, A., 18 Feb 2019, In : Scientific Reports. 9, 1, 8 p., 2192.

Research output: Contribution to journalArticle

Open Access
File
11 Citations (Scopus)
43 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
19 Citations (Scopus)
7 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
25 Citations (Scopus)
18 Downloads (Pure)
2019

Defect Chemistry and Na-Ion Diffusion in Na3Fe2(PO4)3 Cathode Material

Kuganathan, N. & Chroneos, A., 25 Apr 2019, In : Materials. 12, 8, 10 p., 1348.

Research output: Contribution to journalArticle

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

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)
9 Downloads (Pure)