Alexander Chroneos

Alexander Chroneos's AcademicInfluence.com Rankings

Alexander Chroneos

Chemistry

#4652

World Rank

#5738

Historical Rank

Chemical Engineering

#605

World Rank

#625

Historical Rank

chemistry Degrees

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Chemistry

Alexander Chroneos's Degrees

Masters Chemical Engineering Imperial College London

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Alexander Chroneos's Published Works

Number of citations in a given year to any of this author's works

Total number of citations to an author for the works they published in a given year. This highlights publication of the most important work(s) by the author

Published Works

Oxygen diffusion in solid oxide fuel cell cathode and electrolyte materials: mechanistic insights from atomistic simulations (2011) (336)
Anisotropic oxygen diffusion in tetragonal La2NiO4+δ: molecular dynamics calculations (2010) (167)
Diffusion of n-type dopants in germanium (2014) (146)
Oxygen ion diffusion in cation ordered/disordered GdBaCo2O5+δ (2011) (134)
Oxygen Transport in Perovskite and Related Oxides: A Brief Review (2010) (128)
Vacancy-mediated dopant diffusion activation enthalpies for germanium (2008) (128)
Effect of strain on the oxygen diffusion in yttria and gadolinia co-doped ceria (2013) (109)
Impact of uniaxial strain and doping on oxygen diffusion in CeO2 (2014) (104)
Plasma engineering of graphene (2016) (101)
Elastic and thermodynamic properties of new (Zr3−xTix)AlC2 MAX-phase solid solutions (2017) (98)
Synthesis and DFT investigation of new bismuth-containing MAX phases (2016) (92)
Solution Mechanisms for Dopant Oxides in Yttria (2004) (89)
Interstitialcy diffusion of oxygen in tetragonal La2CoO(4+δ). (2011) (86)
Molecular dynamics study of oxygen diffusion in Pr(2)NiO(4+delta). (2010) (83)
Anisotropic oxygen diffusion in PrBaCo2O5.5 double perovskites (2012) (82)
Deviations from Vegard's law in ternary III-V alloys (2010) (82)
Detecting anomalies in time series data via a deep learning algorithm combining wavelets, neural networks and Hilbert transform (2017) (81)
Strain-induced changes to the electronic structure of germanium (2012) (80)
Vacancy-arsenic clusters in germanium (2007) (79)
Diffusion and defect reactions between donors, C, and vacancies in Ge. II. Atomistic calculations of related complexes (2008) (78)
Diffusion of E centers in germanium predicted using GGA+U approach (2011) (78)
Fluorine effect on As diffusion in Ge (2011) (76)
Genetics of superionic conductivity in lithium lanthanum titanates. (2015) (73)
Intrinsic and extrinsic diffusion of indium in germanium (2009) (73)
Carbon, dopant, and vacancy interactions in germanium (2007) (73)
S-functionalized MXenes as electrode materials for Li-ion batteries (2016) (70)
Modeling self-diffusion in UO2 and ThO2 by connecting point defect parameters with bulk properties (2015) (68)
c-axis hopping conductivity in heavily Pr-doped YBCO single crystals (2013) (68)
Modeling self-diffusion in UO2 and ThO2 by connecting point defect parameters with bulk properties (2015) (68)
Point defect engineering strategies to suppress A-center formation in silicon (2011) (68)
Attempts to synthesise quaternary MAX phases (Zr,M)2AlC and Zr2(Al,A)C as a way to approach Zr2AlC (2016) (67)
Mechanical behaviors, lattice thermal conductivity and vibrational properties of a new MAX phase Lu2SnC (2019) (67)
Mechanical behaviors, lattice thermal conductivity and vibrational properties of a new MAX phase Lu2SnC (2019) (67)
Smartphones as an integrated platform for monitoring driver behaviour: The role of sensor fusion and connectivity (2018) (65)
Defect processes in orthorhombic LnBaCo2O5.5 double perovskites. (2011) (63)
Fluorine codoping in germanium to suppress donor diffusion and deactivation (2009) (63)
Dopant-vacancy cluster formation in germanium (2010) (62)
Oxygen diffusion in Sr 0.75 Y 0.25 CoO 2.625 : a molecular dynamics study (2009) (62)
Impact of isovalent doping on the trapping of vacancy and interstitial related defects in Si (2013) (62)
Electro-transport and structure of 1-2-3 HTSC single crystals with different plane defects topologies (2012) (61)
Effect of high pressure on the fluctuation conductivity and the charge transfer of YBa2Cu3O7−δ single crystals (2008) (59)
Phase separation in oxygen deficient ΗοBa2Cu3O7-δ single crystals: effect of high pressure and twin boundaries (2011) (59)
Intrinsic Defects and H Doping in WO3 (2017) (59)
Physical properties of the recently discovered Zr2(Al1−xBix)C MAX phases (2016) (59)
Effect of tin doping on oxygen- and carbon-related defects in Czochralski silicon (2011) (58)
Fluctuation conductivity and pseudogap in HoBa2Cu3O7-δ single crystals under pressure with transport current flowing under an angle 45° to the twin boundaries (2014) (58)
Synthesis and physical properties of (Zr1−x,Tix)3AlC2 MAX phases (2017) (58)
Oxygen defect processes in silicon and silicon germanium (2015) (58)
Nonlinear stability of E centers in Si 1- x Ge x : electronic structure calculations (2008) (57)
Effect of germanium substrate loss and nitrogen on dopant diffusion in germanium (2009) (57)
Defect interactions in Sn1−xGex random alloys (2009) (57)
The Effect of Ion Size on Solution Mechanism and Defect Cluster Geometry (1997) (56)
E centers in ternary Si1−x−yGexSny random alloys (2009) (55)
Interaction of A-centers with isovalent impurities in silicon (2010) (53)
Structural relaxation, metal-to-insulator transition and pseudo-gap in oxygen deficient НоBa2Cu3O7−δ single crystals (2009) (52)
Implantation and diffusion of phosphorous in germanium (2006) (52)
The vacancy in silicon: a critical evaluation of experimental and theoretical results (2008) (52)
Defects, dopants and Mg diffusion in MgTiO3 (2019) (52)
Phosphorous clustering in germanium-rich silicon germanium (2008) (52)
Effect of praseodymium on the electrical resistance of YВа2Сu3О7−δ single crystals (2014) (51)
The thermodynamics of hydride precipitation: The importance of entropy, enthalpy and disorder (2014) (51)
Impact of germanium on vacancy clustering in germanium-doped silicon (2009) (51)
Isovalent impurity‐vacancy complexes in germanium (2007) (50)
Modeling oxygen self-diffusion in UO2 under pressure (2015) (47)
Metal-to-insulator transition in Y1−xPrxBa2Cu3O7−δ single crystals with various praseodymium contents (2013) (47)
Nb‐based MXenes for Li‐ion battery applications (2015) (47)
Effect of annealing on a pseudogap state in untwinned YBa2Cu3O7−δ single crystals (2019) (46)
Evolution of the Fishtail-Effect in Pure and Ag-doped MG-YBCO (2010) (45)
Fluctuation conductivity of oxygen underdoped YBa2Cu3O7−δ single crystals (2014) (44)
Effect of long aging on the resistivity properties of optimally doped YBa2Cu3O7−δ single crystals (2013) (44)
Vacancies and defect levels in III-V semiconductors (2013) (44)
Transport anisotropy and pseudo-gap state in oxygen deficient ReBa2Cu3O7−δ (Re = Y, Ho) single crystals (2008) (44)
Silicene/germanene on MgX2 (X = Cl, Br, and I) for Li-ion battery applications. (2016) (43)
Mechanical behavior, bonding nature and defect processes of Mo2ScAlC2: A new ordered MAX phase (2017) (43)
Excess conductivity and pseudo-gap state in YBCO single crystals slightly doped with Al and Pr (2007) (42)
Relaxation of the normal electrical resistivity induced by high-pressure in strongly underdoped YBa2Cu3O7–δ single crystals (2012) (42)
Nuclear wasteform materials: Atomistic simulation case studies (2013) (42)
Incoherent transport and pseudo-gap in HoBa2Cu3O7−δ single crystals with different oxygen content (2009) (42)
Physical properties and defect processes of M3SnC2 (M = Ti, Zr, Hf) MAX phases: Effect of M-elements (2018) (41)
A-centers in silicon studied with hybrid density functional theory (2013) (41)
Defect process and lithium diffusion in Li2TiO3 (2018) (41)
A perspective on MXenes: Their synthesis, properties, and recent applications (2020) (41)
Experimental synthesis and density functional theory investigation of radiation tolerance of Zr3(Al1‐xSix)C2 MAX phases (2017) (40)
Carbon related defects in irradiated silicon revisited (2014) (40)
INFLUENCE OF HIGH PRESSURE ON THE TEMPERATURE-DEPENDENCE OF THE PSEUDO-GAP IN OXYGEN DEFICIENT YBa2Cu3O7-δ SINGLE CRYSTALS (2010) (40)
INFLUENCE OF LONGITUDINAL MAGNETIC FIELD ON THE FLUCTUATION CONDUCTIVITY IN SLIGHTLY Al-DOPED YBa2Cu3-zAlzO7-δ SINGLE CRYSTALS WITH A GIVEN TOPOLOGY OF PLANE DEFECTS (2011) (40)
Effect of high pressure on the electrical resistivity of optimally doped YBa2Cu3O7−δ single crystals with unidirectional planar defects (2013) (39)
Effect of small oxygen deficiency on the para-coherent transition and 2D–3D crossover in untwinned YBa2СuзО7−δ single crystals (2011) (39)
Effect of high pressure on the metal-dielectric transition and the pseudo-gap temperature range in oxygen deficient YBa2Cu3O7−δ single crystals (2011) (39)
Defect chemistry of doped bixbyite oxides (2007) (39)
Resistive investigation of pseudogap state in non-stoichiometric ReBa2Cu3O7−δ (Re = Y, Ho) single crystals with account for BCS–BEC crossover (2009) (38)
Lithium Doping of ZnO for High Efficiency and Stability Fullerene and Non-fullerene Organic Solar Cells (2019) (36)
Intrinsic defect processes and elastic properties of Ti3AC2 (A = Al, Si, Ga, Ge, In, Sn) MAX phases (2018) (33)
Atomic scale simulations of arsenic–vacancy complexes in germanium and silicon (2006) (32)
Engineering the free vacancy and active donor concentrations in phosphorus and arsenic double donor-doped germanium (2008) (31)
Peculiarities of pseudogap in Y0.95Pr0.05Ba2Cu3O7−δ single crystals under pressure up to 1.7 GPa (2019) (31)
Diffusion of tin in germanium: A GGA+U approach (2011) (30)
Defects and dopant properties of Li3V2(PO4)3 (2019) (29)
Impurity diffusion, point defect engineering, and surface/interface passivation in germanium (2012) (29)
Defects and lithium migration in Li2CuO2 (2018) (28)
Defects, dopants and Li-ion diffusion in Li2SiO3 (2019) (28)
Point defect engineering strategies to retard phosphorous diffusion in germanium. (2013) (27)
Structural, elastic, thermal and lattice dynamic properties of new 321 MAX phases (2019) (27)
Li2SnO3 as a Cathode Material for Lithium-ion Batteries: Defects, Lithium Ion Diffusion and Dopants (2018) (27)
Phase stability and physical properties of (Zr1-Nb )2AlC MAX phases (2019) (27)
Engineering Transport in Manganites by Tuning Local Nonstoichiometry in Grain Boundaries (2018) (27)
Atomic scale models for RBa2Cu3O6.5 and R1- xPrxBa2Cu3O6. 5 compounds (R=Y and lanthanides) (2007) (27)
Composition and temperature dependence of self-diffusion in Si1−xGex alloys (2017) (26)
Unexpected relationship between interlayer distances and surface/cleavage energies in γ-TiAl: density functional study (2011) (26)
Defects, Dopants and Sodium Mobility in Na2MnSiO4 (2018) (26)
Concentration of intrinsic defects and self-diffusion in GaSb (2008) (25)
Connecting point defect parameters with bulk properties to describe diffusion in solids (2016) (25)
Lithium diffusion in Li5FeO4 (2018) (25)
Defect processes in F and Cl doped anatase TiO2 (2019) (24)
A roadmap of strain in doped anatase TiO2 (2018) (24)
A thermodynamic approach of self- and hetero-diffusion in GaAs: connecting point defect parameters with bulk properties (2016) (24)
Phase stability and the arsenic vacancy defect in InxGa1−xAs (2011) (23)
A-centers and isovalent impurities in germanium: density functional theory calculations (2011) (23)
Defect Chemistry and Li-ion Diffusion in Li2RuO3 (2019) (23)
Structure of Sn1−xGex random alloys as obtained from the coherent potential approximation (2011) (23)
New atomic scale simulation models for hydroxides and oxyhydroxides (2006) (23)
Robust Inorganic Hole Transport Materials for Organic and Perovskite Solar Cells: Insights into Materials Electronic Properties and Device Performance (2020) (23)
Formation and evolution of oxygen-vacancy clusters in lead and tin doped silicon (2012) (23)
Learning Driver Braking Behavior Using Smartphones, Neural Networks and the Sliding Correlation Coefficient: Road Anomaly Case Study (2018) (23)
Defects and Dopants in CaFeSi2O6: Classical and DFT Simulations (2020) (23)
Anomaly detection in time series data using a combination of wavelets, neural networks and Hilbert transform (2015) (22)
Modelling zirconium hydrides using the special quasirandom structure approach. (2013) (22)
Impact of doping on the ionic conductivity of ceria: a comprehensive model. (2013) (21)
Vacancy-oxygen defects in silicon: the impact of isovalent doping (2014) (21)
Vacancy formation in MoO3: hybrid density functional theory and photoemission experiments (2016) (21)
Vacancy formation in MoO3: hybrid density functional theory and photoemission experiments (2016) (21)
Li3SbO4 lithium-ion battery material: Defects, lithium ion diffusion and tetravalent dopants (2019) (21)
Defects, Dopants and Lithium Mobility in Li9V3(P2O7)3(PO4)2 (2018) (21)
Hydrogen and nitrogen codoping of anatase TiO2 for efficiency enhancement in organic solar cells (2017) (21)
Insights into the physical properties of a new 211 MAX phase Nb2CuC (2021) (20)
Modelling solid solutions with cluster expansion, special quasirandom structures, and thermodynamic approaches (2017) (20)
Defects, Lithium Mobility and Tetravalent Dopants in the Li3NbO4 Cathode Material (2019) (20)
Insights into the physical properties of a new 211 MAX phase Nb2CuC (2021) (20)
Diffusion in energy materials: Governing dynamics from atomistic modelling (2017) (20)
A thermodynamic approach to self-diffusion in silicon: Evidence of a single diffusion mechanism? (2016) (20)
Influence of planar and point defects on the basal-plane conductivity of HoBaCuO single crystals (2015) (20)
Effect of carbon on dopant–vacancy pair stability in germanium (2011) (19)
Atomic scale simulations of donor–vacancy pairs in germanium (2007) (19)
312 MAX Phases: Elastic Properties and Lithiation (2019) (18)
Adsorption of lead on the surfaces of pristine and B, Si and N-doped graphene (2021) (18)
Special quasirandom structures for gadolinia-doped ceria and related materials. (2012) (18)
Effects of Al substitution by Si in Ti3AlC2 nanolaminate (2021) (17)
Reactor pressure vessel embrittlement: Insights from neural network modelling (2018) (17)
Defect configurations of high- k cations in germanium (2012) (17)
Na3V(PO4)2 cathode material for Na ion batteries: Defects, dopants and Na diffusion (2019) (17)
Influence of atomic structure on the nano-nickel-based catalyst activity produced by solution combustion synthesis in the hydrogenation of maleic acid (2017) (17)
Defect engineering of the oxygen-vacancy clusters formation in electron irradiated silicon by isovalent doping: An infrared perspective (2012) (16)
G-centers in irradiated silicon revisited: A screened hybrid density functional theory approach (2014) (16)
Extrinsic doping in silicon revisited (2010) (16)
Defect Chemistry and Na-Ion Diffusion in Na3Fe2(PO4)3 Cathode Material (2019) (16)
Doping strategies to control A-centres in silicon: insights from hybrid density functional theory. (2014) (16)
Optimized hydrogen positions for aluminium and iron containing hydroxide minerals (2007) (15)
Modification of superconducting and resistive properties of HoBa2Cu3O7−δ single crystals under application-removal of high hydrostatic pressure (2016) (15)
Fluctuation conductivity and possible pseudogap state in FeAs-based superconductor EuFeAsO0.85F0.15 (2015) (15)
Special quasirandom structures for binary/ternary group IV random alloys (2010) (15)
Modeling indium diffusion in germanium by connecting point defect parameters with bulk properties (2015) (15)
Vacancy–indium clusters in implanted germanium (2010) (15)
Connecting bulk properties of germanium with the behavior of self- and dopant diffusion (2015) (14)
Toward Defect Engineering Strategies to Optimize Energy and Electronic Materials (2017) (14)
Describing oxygen self-diffusion in PuO2 by connecting point defect parameters with bulk properties (2015) (14)
Elastic behaviour and radiation tolerance in Nb-based 211 MAX phases (2020) (14)
Self-diffusion in garnet-type Li7La3Zr2O12 solid electrolytes (2021) (14)
Preparation of hydrogen, fluorine and chlorine doped and co-doped titanium dioxide photocatalysts: a theoretical and experimental approach (2021) (14)
Different diffusion mechanisms of oxygen in ReBa 2 Cu 3 O 7-x (Re = Y, Ho) single crystals (2017) (14)
Interaction of oxygen vacancies in yttrium germanates. (2012) (13)
Doping and cluster formation in diamond (2011) (13)
Thermodynamic calculations of oxygen self-diffusion in mixed-oxide nuclear fuels (2016) (13)
LOCALIZATION EFFECT AND PSEUDOGAP IN PRASEODYMIUM DOPED Y1-zPrzBa2Cu3O7-δ SINGLE CRYSTALS (2012) (13)
Ultrafast palladium diffusion in germanium (2015) (13)
Carbon, oxygen and intrinsic defect interactions in germanium-doped silicon (2011) (13)
Defect engineering strategies for germanium (2013) (13)
The encapsulation selectivity for anionic fission products imparted by an electride (2019) (13)
Co-doping with antimony to control phosphorous diffusion in germanium (2013) (13)
Impact of isovalent doping on radiation defects in silicon (2013) (13)
Synthesis and physical properties of ( Zr 1 x , Ti x ) 3 AlC 2 MAX phases (2017) (13)
Production and evolution of A-centers in n-type Si1−xGex (2013) (12)
Technetium Encapsulation by A Nanoporous Complex Oxide 12CaO•7Al2O3 (C12A7) (2019) (12)
Numerical investigation on the operation and energy demand of a seven-stage metal hydride hydrogen compression system for Hydrogen Refuelling Stations (2020) (12)
Phosphorous–vacancy–oxygen defects in silicon (2013) (12)
Defect Process, Dopant Behaviour and Li Ion Mobility in the Li2MnO3 Cathode Material (2019) (12)
Defects, Diffusion, and Dopants in Li2Ti6O13: Atomistic Simulation Study (2019) (11)
Electronic properties of the Sn1−xPbxO alloy and band alignment of the SnO/PbO system: a DFT study (2020) (11)
Effect of trivalent dopants on local coordination and electronic structure in crystalline and amorphous ZnO (2014) (11)
Diffusion and Dopant Activation in Germanium: Insights from Recent Experimental and Theoretical Results (2019) (11)
Defect, Diffusion and Dopant Properties of NaNiO2: Atomistic Simulation Study (2019) (10)
Electronic structures, bonding natures and defect processes in Sn-based 211 MAX phases (2019) (10)
Antisites and anisotropic diffusion in GaAs and GaSb (2013) (10)
Electronegativity and doping in Si1-xGex alloys (2020) (10)
Ab initio modeling of MAX phase solid solutions using the special quasirandom structure approach. (2018) (10)
Copper diffusion in germanium: connecting point defect parameters with bulk properties (2015) (10)
Defect pair formation in fluorine and nitrogen codoped TiO2 (2018) (10)
Stress-enhanced lithiation in MAX compounds for battery applications (2017) (10)
Electronic structures, bonding natures and defect processes in Sn-based 211 MAX phases (2019) (10)
Defect processes of M3AlC2 (M = V, Zr, Ta, Ti) MAX phases (2017) (9)
Impact of boron and indium doping on the structural, electronic and optical properties of SnO2 (2021) (9)
Mechanisms of nonstoichiometry in HfN1−x (2009) (9)
Erratum “Impact of isovalent doping on the trapping of vacancy and interstitial related defects in Si” [J. Appl. Phys. 113, 113506 (2013)] (2013) (9)
Interaction of n-type dopants with oxygen in silicon and germanium (2012) (9)
Impact of isovalent doping on the formation of the CiOi(SiI)n defects in silicon (2017) (9)
Defect processes of M3AlC2 (M = V, Zr, Ta, Ti) MAX phases (2017) (9)
VV and VO2 defects in silicon studied with hybrid density functional theory (2015) (8)
Ru-Doped Single Walled Carbon Nanotubes as Sensors for SO2 and H2S Detection (2021) (8)
Mg diffusion in Si on a thermodynamic basis (2018) (8)
Impact of isovalent defect engineering strategies on carbon-related clusters in silicon (2013) (8)
Migration of sodium and lithium interstitials in anatase TiO2 (2018) (8)
Migration of sodium and lithium interstitials in anatase TiO2 (2018) (8)
Intrinsic defect processes in bixbyite sesquioxides (2007) (8)
A carbon-doped tantalum dioxyfluoride as a superior electron transport material for high performance organic optoelectronics (2020) (8)
Mg6MnO8 as a Magnesium-Ion Battery Material: Defects, Dopants and Mg-Ion Transport (2019) (8)
Infrared studies of the evolution of the CiOi(SiI) defect in irradiated Si upon isothermal anneals (2016) (8)
Encapsulation of heavy metals by a nanoporous complex oxide 12CaO · 7Al2O3 (2019) (8)
The CiOi(SiI)2 defect in silicon: density functional theory calculations (2017) (8)
Antisites in III-V semiconductors: Density functional theory calculations (2014) (8)
Oxygen diffusion in germanium: interconnecting point defect parameters with bulk properties (2015) (8)
Defect processes in Li2ZrO3: insights from atomistic modelling (2017) (8)
Investigation of oxygen self-diffusion in PuO2 by combining molecular dynamics with thermodynamic calculations (2016) (8)
Excess Conductivity of Y0.95Pr0.05Ba2Cu3O7-xSingle Crystals (2007) (8)
Probabilistic kernel machines for predictive monitoring of weld residual stress in energy systems (2018) (8)
Palladium diffusion in germanium (2015) (8)
Impact of oxygen on the diffusion of silicon in germanium: density functional theory calculations (2010) (7)
Effect of electron irradiation on the fluctuation conductivity in YBa2Cu3O7−δ single crystals (2018) (7)
Materials Science and Engineering B (2011) (7)
Interaction of metal impurities with native oxygen defects in GeO2 (2013) (7)
Defect Chemistry, Sodium Diffusion and Doping Behaviour in NaFeO2 Polymorphs as Cathode Materials for Na-Ion Batteries: A Computational Study (2019) (7)
Cadmium trapping by C60 and B-, Si-, and N-doped C60 (2019) (7)
Germanium diffusion in aluminium: connection between point defect parameters with bulk properties (2015) (6)
Encapsulation of cadmium telluride nanocrystals within single walled carbon nanotubes (2019) (6)
Optimizing oxygen diffusion in cathode materials for solid oxide fuel cells (2012) (6)
Thermodynamic modelling of fast dopant diffusion in Si (2018) (6)
METAL–INSULATOR TRANSITION AND THE TEMPERATURE OF THE PSEUDOGAP ANOMALY OPENING IN PRASEODYMIUM DOPED Y1-zPrzBa2Cu3O7-δ SINGLE CRYSTALS (2013) (6)
Dopant-defect interactions in Ge: Density functional theory calculations (2012) (6)
Charge and heat transfer of the Ti3AlC2 MAX phase (2018) (6)
A Computational Study of Defects, Li-Ion Migration and Dopants in Li2ZnSiO4 Polymorphs (2019) (6)
Infrared study of defects in nitrogen-doped electron irradiated silicon (2016) (6)
Impact of the germanium concentration in the stability of E-centers and A-centers in Si1−xGex (2013) (6)
Defect energetics in the SrTiO3-LaCrO3 system (2021) (6)
Study on the operation and energy demand of dual-stage Metal Hydride Hydrogen Compressors under effective thermal management (2021) (6)
Behavior of Li-ion on the surface of Ti3C2–T (T = O, S, Se, F, Cl, Br) MXene: Diffusion barrier and conductive pathways (2021) (6)
Atomistic Simulations of the Defect Chemistry and Self-Diffusion of Li-ion in LiAlO2 (2019) (6)
Defect Processes in Halogen Doped SnO2 (2021) (5)
Defect, transport, and dopant properties of andradite garnet Ca3Fe2Si3O12 (2020) (5)
Effect of Praseodymium Concentration on the Excess Conductivity Near the Critical Temperature of Y1−zPrzBa2Cu3O7−δ Single Crystals (2013) (5)
A critical assessment of interatomic potentials for ceria with application to its elastic properties revisited (2013) (5)
Oxygen aggregation kinetics, thermal donors and carbon-oxygen defect formation in silicon containing carbon and tin (2015) (5)
Defect Properties and Lithium Incorporation in Li2ZrO3 (2021) (5)
Tin diffusion in germanium: a thermodynamic approach (2017) (5)
Scattering Processes of Normal and Fluctuating Carriers in ReBa_2Cu_3O_{7-δ} (Re = Y, Ho) Single Crystals with Unidirectional Twin Boundaries (2007) (5)
Stability of impurity–vacancy pairs in germanium carbide (2008) (5)
Defect volumes of BO2 doped Y2O3 (B = Ti, Zr, Hf and Ce) (2010) (4)
Stability of Coinage Metals Interacting with C60 (2019) (4)
Mg-ion diffusion on the surface of Ti3C2S2 MXene (2022) (4)
CO2 capture by Li‐functionalized silicene (2016) (4)
INFLUENCE OF INTRINSIC PINNING ON THE RESISTIVE PROPERTIES OF YBa2Cu3O7-δ SINGLE CRYSTALS (2013) (4)
Enhanced oxygen diffusion in nano-structured ceria (2018) (4)
Localised vibrational mode spectroscopy studies of self-interstitial clusters in neutron irradiated silicon (2013) (4)
Transverse resistance of YBa2Cu3O7-δ single crystals (2015) (4)
Hydrogen Adsorption on Ru-Encapsulated, -Doped and -Supported Surfaces of C60 (2020) (4)
Electronegativity and doping in semiconductors (2012) (4)
Defects, dopants and lithium incorporation in LiPON electrolyte (2022) (4)
Oxygen self-diffusion in apatites (2012) (4)
Gold and silver diffusion in germanium: a thermodynamic approach (2016) (4)
Theoretical Modeling of Defects, Dopants, and Diffusion in the Mineral Ilmenite (2019) (4)
Diffusion coalescence in НоBa2Cu3O7−x single crystals under the application of hydrostatic pressure (2017) (4)
The CiCs(SiI)n Defect in Silicon from a Density Functional Theory Perspective (2018) (4)
Lithium Storage in Nanoporous Complex Oxide 12CaO•7Al2O3 (C12A7) (2020) (4)
Oxygen-vacancy defects in electron-irradiated Si: the role of carbon in their behavior (2014) (4)
Vacancy-oxygen defects in p-type Si1−xGex (2014) (4)
Di-interstitial defect in silicon revisited (2013) (4)
Structural, defect, transport and dopant properties of AgNbO 3 (2020) (3)
Solution mechanisms for Li2O in Sc2O3, Y2O3 and La2O3 (2005) (3)
Computer modeling investigation of MgV2O4 for Mg-ion batteries (2020) (3)
1.02 – Fundamental Point Defect Properties in Ceramics (2012) (3)
Impact of local composition on the energetics of E-centres in Si1−xGex alloys (2019) (3)
Li-diffusion pathways in Zr2CO2 and Zr2CS2 MXenes using the Bond Valence Sum model (2022) (3)
Influence of thermal cycling on the optical and the electrical properties of atmospheric pressure chemical vapor deposited tin oxide films grown using water and methanol vapors as oxidizers (2021) (3)
Impact of Carbon on the Diffusion of Donor Atoms in Germanium (2009) (3)
Self-Diffusion in Perovskite and Perovskite Related Oxides: Insights from Modelling (2020) (3)
Infrared signals correlated with self-interstitial clusters in neutron-irradiated silicon (2013) (3)
DFT insights into the electronic structure, mechanical behaviour, lattice dynamics and defect processes in the first Sc-based MAX phase Sc2SnC (2021) (3)
Defects, diffusion, dopants and encapsulation of Na in NaZr2(PO4)3 (2021) (3)
Controlling A-center concentration in silicon through isovalent doping: mass action analysis (2016) (3)
Defect interactions in Sn 1- x Ge x random alloys (2009) (3)
Relaxation effect of pressure on the pseudogap in oxygen underdoped HoBa2Cu3O7−δ single crystals (2013) (3)
Encapsulation and substitution of Fe in C12A7 (12CaO⋅7Al2O3) (2020) (3)
Isovalent doping and the CiOi defect in germanium (2018) (3)
Interstitialcy diffusion of oxygen in tetragonal La 2 CoO 4 + d (2010) (3)
Silicon diffusion in germanium described by connecting point defect parameters with bulk properties (2015) (3)
The Interstitial Carbon–Dioxygen Center in Irradiated Silicon (2020) (3)
The Effect of the Precursor Solution’s Pretreatment on the Properties and Microstructure of the SCS Final Nanomaterials (2019) (2)
Phase stability and the arsenic vacancy defect in In (2011) (2)
Grain Boundaries: Engineering Transport in Manganites by Tuning Local Nonstoichiometry in Grain Boundaries (Adv. Mater. 4/2019) (2019) (2)
Modeling defect reactions processes to study the impact of carbon on the production and conversion of A-centers in silicon (2014) (2)
Defects, diffusion and dopants in the ceramic mineral “Lime- Feldspar” (2021) (2)
Mechanism of dopant-vacancy association in α-quartz GeO2 (2013) (2)
Atomic structure and electronic properties of hydrogenated X (=C, Si, Ge, and Sn) doped TiO2: A theoretical perspective (2020) (2)
Oxygen Diffusion in Ordered/Disordered Double Perovskites (2011) (2)
Fundamental Point Defect Properties in Ceramics (2020) (2)
Optimization of the hydrogen response characteristics of halogen-doped SnO2 (2023) (2)
Electromagnetic excitation in complex materials (2014) (2)
Ion incorporation on the Zr2CS2 MXene monolayer towards better-performing rechargeable ion batteries (2022) (2)
Influence of Uniform Compression on the Temperature Dependence of the Pseudogap of Medium-Praseodymium-Doped Y1−xPrxBa2Cu3O7−δ Single Crystals (2021) (2)
Molecular dynamics study of oxygen diffusion in Pr 2 NiO 4 + d (2010) (2)
Nitrogen-vacancy defects in germanium (2022) (2)
Conductivity of YBCO ceramics in a wide range of temperatures and hafnium impurities concentrations (2016) (2)
Ultrafast epitaxial growth of CuO nanowires using atmospheric pressure plasma with enhanced electrocatalytic and photocatalytic activities (2021) (2)
Temperature dependence of the pseudogap in Y1−zPrzBa2Cu3O7−δ single crystals (2013) (2)
Influence of defects on anisotropy of electrical resistivity in YBa2Cu3O7-δ\documentclass[12pt]{minimal} \usepackage{amsmath} \usepackage{wasysym} \usepackage{amsfonts} \usepackage{amssymb} \usepackage{amsbsy} \usepackage{mathrsfs} \usepackage{upgreek} \setlength{\oddsidemargin}{-69pt} \begin{docume (2020) (2)
Impact of oxygen on gallium doped germanium (2021) (2)
COEXISTENCE OF DIFFERENT TYPES OF TRANSVERSE CONDUCTIVITY IN Y1-xPrxBa2Cu3 O7-δ SINGLE CRYSTALS WITH DIFFERENT PRASEODYMIUM CONCENTRATIONS (2013) (2)
Response to “Comment on ‘Diffusion of n-type dopants in germanium’ ” [Appl. Phys. Rev. 2, 036101 (2015)] (2015) (2)
Strategies to suppress A-center formation in silicon and germanium from a mass action analysis viewpoint (2014) (2)
Encapsulation of volatile fission products in a two-dimensional dicalcium nitride electride (2020) (2)
Effect of high pressure on temperature dependences of the resistivity in the ab-plane of Y0.77Pr0.23Ba2Cu3O7-δ single crystals (2022) (2)
Atomic structure and electronic properties of hydrogenated X (=C, Si, Ge, and Sn) doped TiO2: A theoretical perspective (2020) (2)
Modelling the Defect Processes of Materials for Energy Applications (2022) (1)
Effect of hydrogen on the electrical resistance of NbSe2 in a wide temperature range (2021) (1)
The Ci(SiI)n defect in neutron-irradiated silicon (2019) (1)
O vacancy formation in (Pr/Gd)BaCo2O5.5 and the role of antisite defects. (2017) (1)
Interstitial lithium doping in SrTiO3 (2021) (1)
Modification by high pressure of fluctuation paraconductivity of underdoped HoBa2Cu3O7-δ single crystals (2016) (1)
The CO V defect in neutron irradiated silicon: An infrared spectroscopy study (2018) (1)
One-dimensional yttrium silicide electride (Y5Si3:e−) for encapsulation of volatile fission products (2021) (1)
Structural, Electronic, and Optical Properties of Group 6 Doped Anatase TiO2: A Theoretical Approach (2021) (1)
Defects, dopants and Mg diffusion in MgTiO3 (2019) (1)
Defect and dopant properties in CaMnO3 (2021) (1)
Composition variation and electron irradiation effects on the fluctuation conductivity in Y1–zPrzBa2Cu3O7−δ single crystals (2020) (1)
Defect Processes in Germanium (2008) (1)
Influence of high pressure on the temperature dependence of electrical resistivity of Y1-xPrxBa2Cu3O7-δ single crystals (2021) (1)
Effect of Long Aging on the Resistivity Properties of Aluminum Doped YBa2Cu3−yAlyO7−δ Single Crystals with a Given Twin Boundary Topology (2014) (1)
Engineering VO, CiOi and CiCs defects in irradiated Si through Ge and Pb doping (2015) (1)
Influence of electron irradiation on fluctuation conductivity and pseudogap in YBa2Cu3O7−δ single crystals (2022) (1)
Vacancy-Fluorine Clusters in Silicon (2011) (1)
Vapor-Liquid-Solid Growth and Properties of One Dimensional PbO and PbO/SnO2 Nanowires (2022) (1)
Substitutional carbon-dioxygen center in irradiated silicon (2021) (1)
Effect of Hafnium Impurities on the Magnetoresistance of $$\hbox {YBa}_{2}\hbox {Cu}_{3}\hbox {O}_{7-\delta }$$YBa2Cu3O7-δ (2017) (1)
Relative concentrations of carbon related defects in silicon (2016) (1)
312 MAX phases: Nuclear applications of M3AlC2 (2019) (1)
Temperature and Ambient Band Structure Changes in SnO2 for the Optimization of Hydrogen Response (2023) (0)
Effect of a liquid phase on the plastic deformation of MAX phase-based (Ti–Al–C) multicomponent ceramics (2020) (0)
Intrinsic and extrinsic diffusion of indium in germanium Journal Item (2009) (0)
Influence of defects on anisotropy of electrical resistivity in $$\hbox {YBa}_2\hbox {Cu}_3\hbox {O}_{7-\delta }$$ (2020) (0)
Structure of Sn 1 2 xGex random alloys as obtained from the coherent potential approximation (2011) (0)
Vacancy-oxygen defects in p-type Si 1 2 xGex (2014) (0)
Tuning the electronic properties of C12A7 via Sn doping and encapsulation (2020) (0)
E centers in ternary Si 1- x-y Ge x Sn y random alloys (2009) (0)
Vacancy defects in nitrogen doped diamond (2023) (0)
Defects, diffusion and dopants in Li8SnO6 (2021) (0)
Li2SnO3 as a Cathode Material for Lithium-ion Batteries: Defects, Lithium Ion Diffusion and Dopants (2018) (0)
Functionalized Graphene-Incorporated Cupric Oxide Charge-Transport Layer for Enhanced Photoelectrochemical Performance and Hydrogen Evolution (2023) (0)
Computational modelling to enhance safety of operating nuclear power plants (2016) (0)
Electrophysical properties of nanoporous cerium dioxide–water system (2016) (0)
Pressure effect on the electrical resistance of Y0.77Pr0.23Ba2Cu3O7-δ single crystals (2020) (0)
Fluctuation conductivity and pseudogap in single crystals under pressure with transport current flowing under an angle 45Â° to the twin boundaries (2014) (0)
Relaxation of the electric resistance in YBa2Cu3O7-x single crystals at room temperature (2017) (0)
Structure of Sn 1x Ge x random alloys as obtained from the coherent potential approximation Journal Item (2019) (0)
Electron irradiation and annealing effects on the pseudogap in optimally doped YBCO single crystals (2020) (0)
Electro- and Heat Transfer in $$\mathbf{Cd}_{\mathbf{0.22}}\mathbf{\hbox {Hg}}_{\mathbf{0.78}}{} \mathbf{Te}$$Cd0.22Hg0.78Te Single Crystals in the Temperature Range of Their Practical Applications (2017) (0)
’ s repository of research publications and other research outputs Molecular dynamics study of oxygen diffusion in (2016) (0)
’ s repository of research publications and other research outputs Special quasirandom structures for gadolinia-doped ceria and related materials Journal Item (2018) (0)
Room-temperature deposited fluorine-doped tantalum pentoxide for stable organic solar cells (2022) (0)
A Molecular Dynamics Study of Anisotropic Oxygen Diffusion in La2NiO4+δ (2009) (0)
Oxygen migration in doped BaGdInO4 (2021) (0)
Di ff usion and Dopant Activation in Germanium : Insights from Recent Experimental and Theoretical Results (2019) (0)
Core–shell carbon-polymer quantum dot passivation for near infrared perovskite light emitting diodes (2022) (0)
Defect Chemistry and Migration Processes in Disordered Oxides (2017) (0)
Defect processes of Ti3AC2 MAX phases: Insights from atomistic modelling (2017) (0)
The Open University ’ s repository of research publications and other research outputs Anisotropic oxygen diffusion in tetragonal La 2 NiO 4 + : molecular dynamics calculations (2016) (0)
Defects and lithium migration in Li2CuO2 (2018) (0)
Defects and lithium migration in Li 2 CuO 2 (2018) (0)
Effect of annealing on a pseudogap state in untwinned YBa2Cu3O7−δ single crystals (2019) (0)
Defects, Dopants and Lithium Mobility in Li9V3(P2O7)3(PO4)2 (2018) (0)
Confinement of volatile fission products in the crystalline organic electride Cs+(15C5)2•e− (2022) (0)
Association between oxygen vacancies and trivalent dopants in crystalline and amorphous ZnO (2014) (0)
Effect of longitudinal magnetic field on the excess conductivity of monodomain YBa2Cu3O7-d single crystals (2016) (0)
Doping and cluster formation in diamond Journal Item (2018) (0)
Dinitrogen activation by zirconium dimer loaded C60 (2019) (0)
Disordered Ionic Conductors (2016) (0)
Molecular dynamics study of oxygen diffusion in Pr 2 NiO (2016) (0)
Evolution of the metal–insulator transition in oxygen nonstoichiometric YBa2Cu3O7−δ single crystals under pressure (2013) (0)
Fluorine effect on As diffusion in (2013) (0)
Grain Boundary Diffusion in Fluorite Structured Oxides (2017) (0)
Mayenite Electrides and Their Doped Forms for Oxygen Reduction Reaction in Solid Oxide Fuel Cells (2020) (0)
Probing the electronic structure of fine and large-grained SnO2 layers by spectroscopic ellipsometry and current-voltage measurements (2021) (0)
Effect of Structural Relaxation on the Metal–Insulator Transition in Heavily Underdoped YBa$$_2$$2Cu$$_3$$3O$$_{7-\delta }$$7-δ Single Crystals (2015) (0)
Fluorine effect on As diffusion in Ge Journal Article (2016) (0)
Defects, Dopants and Sodium Mobility in Na2MnSiO4 (2018) (0)
Transverse resistance in HoBa2Cu3O7−δ single crystals (2015) (0)
The Open University ’ s repository of research publications and other research outputs Molecular dynamics study of oxygen diffusion in Pr (2016) (0)
Fluorine effect on As diffusion in Ge Journal Item (2018) (0)
The Open University ’ s repository of research publications and other research outputs Fluorine effect on As diffusion in Ge Journal (2013) (0)
Computational study of energy materials (2018) (0)
Lithium diffusion in Li5FeO4 (2018) (0)
Latest advances and comparative analysis of MXenes as anode and cathode electrodes in secondary batteries (2023) (0)
Defects, Diffusion and Dopants in Sillimanite (2020) (0)
Composition and temperature dependence of self-diffusion in Si1−xGex alloys (2017) (0)
Impact of temperature and pressure on phase separation in the basal plane of Y0.77Pr0.23Ba2Cu3O7–δ single crystals (2022) (0)
Impact of local composition on the energetics of E-centres in Si1−xGex alloys (2019) (0)
Carbon Nanodots as Electron Transport Materials in Organic Light Emitting Diodes and Solar Cells (2022) (0)
Defects and Calcium Diffusion in Wollastonite (2020) (0)
Atomic-scale studies of garnet-type Mg3Fe2Si3O12: Defect chemistry, diffusion and dopant properties (2020) (0)
Defects, Lithium Mobility and Tetravalent Dopants in the Li3NbO4 Cathode Material (2019) (0)
Lanthanide doping and external parameters in RBa2Cu3O7–δ superconductors: A brief review (2023) (0)
VV and V O 2 defects in silicon studied with hybrid density functional theory (2015) (0)
The Open University ’ s repository of research publications and other research outputs Plasma engineering of graphene (2016) (0)
Defect Chemistry and Li-ion Diffusion in Li2RuO3 (2019) (0)
Resistive Investigation of Pseudogap State in Non‐stoichiometric LnBa2Cu3O7‐δ (Ln: Y, Ho) Single Crystals with Account for BCS—BEC Crossover. (2010) (0)
Hydrogen and nitrogen codoping of anatase TiO2 for efficiency enhancement in organic solar cells (2017) (0)
Effect of Structural Relaxation on the Metal–Insulator Transition in Heavily Underdoped YBa 2 Cu 3 O 7 − δ Single Crystals (2015) (0)
A Heavily Substituted Manganite in an Ordered Nanocomposite for Long-Term Energy Applications (2021) (0)
COMPUTER SIMULATION OF THE ATOMIC SCALE OF Y 1-X PR X BA 2 CU 3 O 6.5 COMPOUNDS (2006) (0)
Stabilization of Zrn+1AlCn MAX Phases: Issues and Achievements (2016) (0)
Effect of Hafnium Impurities on the Magnetoresistance of YBa2Cu3O7-δ\documentclass[12pt]{minimal} \usepackage{amsmath} \usepackage{wasysym} \usepackage{amsfonts} \usepackage{amssymb} \usepackage{amsbsy} \usepackage{mathrsfs} \usepackage{upgreek} \setlength{\oddsidemargin}{-69pt} \begin{document}$$\h (2016) (0)
Publisher's Note: Phase stability and the arsenic vacancy defect in In x Ga 1-x As [Phys. Rev. B 84, 184108 (2011)] (2011) (0)
Atomistic models for R1–xPrxBa2Cu3O7–δ (R = Y and lanthanides) and related oxides (2009) (0)
A molecular dynamics study of anisotropic oxygen diffusion in La 2 NiO 4+[delta] (2009) (0)
Formation of atomic fluorine anions in 12CaO·7Al2O3 (2021) (0)
Comparative Study of Oxygen- and Carbon-Related Defects in Electron Irradiated Cz–Si Doped with Isovalent Impurities (2022) (0)
Defects, Lithium Ion Diffusion and Trivalent Dopants in Li2MnO2 (2019) (0)
Appendix – Atomic-scale computer simulation of functional materials: methodologies and applications (2012) (0)
Seventy-Five Years since the Point-Contact Transistor: Germanium Revisited (2022) (0)
Modification by high pressure of fluctuation paraconductivity of underdoped НоBa 2 Cu 3 O 7-δ single crystals (2017) (0)
Defects and dopant properties of Li3V2(PO4)3 (2019) (0)
Semi-empirical modelling of the di-interstitial defect in silicon (2014) (0)
Effect of Long Aging on the Resistivity Properties of Aluminum Doped YBa2Cu3−yAlyO7−δ Single Crystals with a Given Twin Boundary Topology (2013) (0)
Self-diffusion in garnet-type Li7La3Zr2O12 solid electrolytes (2021) (0)
Effect of Praseodymium Concentration on the Excess Conductivity Near the Critical Temperature of Y1−zPrzBa2Cu3O7−δ Single Crystals (2012) (0)
M3AlC2 MAX phases for nuclear applications (2017) (0)
Diffusion of the superconducting transition in HTSC (2017) (0)

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