List of works - Denis Music

A proposal for an unusually stiff and moderately ductile hard coating material: Mo2BC

Ab initio calculations and thermodynamic modeling for the Fe–Mn–Nb system

Ab initio calculations of the structure and mechanical properties of vanadium oxides

scientific article

Ab initio lattice stability of fcc and hcp Fe-Mn random alloys.

scientific article

Ab initio study of basal slip in Nb(2)AlC.

scientific article

Ab initio study of the effect of Si on the phase stability and electronic structure of γ- and α-Al2O3.

scientific article

Ab initiostudy of ductility inM2AlC(M=Ti, V, Cr)

scholarly article in Physical Review B, vol. 75 no. 17, May 2007

Ab initio molecular dynamics model for density, elastic properties and short range order of Co-Fe-Ta-B metallic glass thin films

scientific article

Ab initio study of effects of substitutional additives on the phase stability of γ-alumina.

scientific article

Amorphous-crystalline transition in thermoelectric NbO2

Atomistic Modeling-Based Design of Novel Materials

Bonding and classification of nanolayered ternary carbides

scientific article

Bonding and elastic properties of amorphous AlYB14

Combinatorial evaluation of phase formation and magnetic properties of FeMnCoCrAl high entropy alloy thin film library.

scientific article published on 27 May 2019

Correlative plasma-surface model for metastable Cr-Al-N: Frenkel pair formation and influence of the stress state on the elastic properties

article published in 2017

Coulomb-potential-dependent decohesion of Magnéli phases

scientific article

Critical evaluation of the colossal Seebeck coefficient of nanostructured rutile MnO2.

scientific article

Crystallite size-dependent metastable phase formation of TiAlN coatings

scientific article published on 23 November 2017

Deformation behavior of Re alloyed Mo thin films on flexible substrates: In situ fragmentation analysis supported by first-principles calculations

scientific article

Determining the Elasticity of Materials Employing Quantum-mechanical Approaches: From the Electronic Ground State to the Limits of Materials Stability

Development of thin film cathodes for lithium-ion batteries in the material system Li–Mn–O by r.f. magnetron sputtering

Effect of Si additions on thermal stability and the phase transition sequence of sputtered amorphous alumina thin films

article

Effect of chemical composition, defect structure, and stress state on the elastic properties of (V1-x Al x )1-y N y

scientific article published on 23 September 2019

Elastic properties of amorphous T 0.75Y0.75B14 (T = Sc, Ti, V, Y, Zr, Nb) and the effect of O incorporation on bonding, density and elasticity (T' = Ti, Zr).

scientific article

Elastic properties of face-centred cubic Fe–Mn–C studied by nanoindentation and ab initio calculations

Elastic properties of fcc Fe-Mn-X (X = Cr, Co, Ni, Cu) alloys studied by the combinatorial thin film approach and ab initio calculations

scientific article

Electronic hybridisation implications for the damage-tolerance of thin film metallic glasses

scientific article

Electronic structure and elastic properties of Y(n+1)Co(3n+5)B(2n) ([Formula: see text]).

scientific article

Electronic structure tuning of the anomalous thermoelastic behavior in Nb- X ( X = Zr, V, Mo) solid solutions

Equilibrium structure of δ-Bi(2)O(3) from first principles.

scientific article

First Principles Investigation of Anomalous Pressure-Dependent Thermal Conductivity of Chalcopyrites

scientific article published on 25 October 2019

From qualitative to quantitative description of the anomalous thermoelastic behavior of V, Nb, Ta, Pd and Pt

scientific article published on 22 February 2019

From quantum to continuum mechanics: studying the fracture toughness of transition metal nitrides and oxynitrides

scientific article published on 17 December 2017

High-throughput exploration of thermoelectric and mechanical properties of amorphous NbO2 with transition metal additions

article

Influence of Si and N additions on structure and phase stability of Ge(2)Sb(2)Te(5) thin films

scientific article

Kinetically Limited Phase Formation of Pt-Ir Based Compositionally Complex Thin Films

scientific article published on 16 May 2020

Modeling of metastable phase formation diagrams for sputtered thin films

scientific article

Molecular Coverage Determines Sliding Wear Behavior of n-Octadecylphosphonic Acid Functionalized Cu-O Coated Steel Disks against Aluminum

scientific article published on 08 January 2020

Nanometre-scale 3D defects in Cr2AlC thin films.

scientific article

On the solubility of yttrium in RuO2

scholarly article by Denis Music et al published September 2011 in Journal of Applied Physics

Origin of the nitrogen over- and understoichiometry in Ti(0.5)Al(0.5)N thin films.

scientific article

Phase stability of AlYB(14) sputtered thin films

scientific article

Quantum mechanically guided design of Co43Fe20Ta(5.5)X(31.5) (X=B, Si, P, S) metallic glasses

scientific article

Recent progress and new directions in density functional theory based design of hard coatings

Revealing the relationships between chemistry, topology and stiffness of ultrastrong Co-based metallic glass thin films: A combinatorial approach

Stability, elastic properties and fracture toughness of Al0.75X0.75B14 (X=Sc, Ti, V, Cr, Y, Zr, Nb, Mo) investigated using ab initio calculations.

scientific article

Stiffness and toughness prediction of Co–Fe–Ta–B metallic glasses, alloyed with Y, Zr, Nb, Mo, Hf, W, C, N and O by ab initio molecular dynamics

scientific article

Structural transformation of sputtered o-LiMnO2 thin-film cathodes induced by electrochemical cycling

Synthesis and mechanical properties of Fe–Nb–B thin-film metallic glasses

Synthesis of Intermetallic (Mg1-x,Alx)2Ca by Combinatorial Sputtering

scientific article published on 18 September 2019

Synthesis, microstructure, and mechanical properties of YPd3B thin films

Systematic study on the electronic structure and mechanical properties of X2BC (X = Mo, Ti, V, Zr, Nb, Hf, Ta and W).

scientific article

Systematic study on the pressure dependence ofM2AlCphases(M=Ti,V,Cr,Zr,Nb,Mo,Hf,Ta,W)

scholarly article in Physical Review B, vol. 76 no. 22, December 2007

The correlation between the electronic structure and elastic properties of nanolaminates

The influence of additions of Al and Si on the lattice stability of fcc and hcp Fe-Mn random alloys

scientific article

Theoretical study of phase stability and elastic properties of T 0.75Y0.75B14 (T = Sc, Ti, V, Y, Zr, Nb, Si).

scientific article

Thermal expansion of Pd-based metallic glasses by ab initio methods and high energy X-ray diffraction

scientific article published on 16 November 2017

Thermal stability of Ti3SiC2 thin films

Thermodynamic and Electrochemical Properties of the Li–Co–O and Li–Ni–O Systems

scientific article published on 15 December 2011

Thermodynamic description of the LiNiO2–NiO2 pseudo-binary system and extrapolation to the Li(Co,Ni)O2–(Co,Ni)O2 system

scientific article published in June 2012

Thermodynamic description of the layered O3 and O2 structural LiCoO2–CoO2 pseudo-binary systems

Topology and electronic structure of flexible (Nb,Ru)O2 thermoelectrics

scientific article

Tuneable thermal expansion of poly (3,4-ethylenedioxythiophene) polystyrene sulfonate

scientific article published on 11 January 2019

Ultra-stiff metallic glasses through bond energy density design

scientific article

Vacancy filling effect in thermoelectric NbO.

scientific article

List of works by Denis Music

A proposal for an unusually stiff and moderately ductile hard coating material: Mo2BC

Ab initio calculations and thermodynamic modeling for the Fe–Mn–Nb system

Ab initio calculations of the structure and mechanical properties of vanadium oxides

Ab initio lattice stability of fcc and hcp Fe-Mn random alloys.

Ab initio study of basal slip in Nb(2)AlC.

Ab initio study of the effect of Si on the phase stability and electronic structure of γ- and α-Al2O3.

Ab initiostudy of ductility inM2AlC(M=Ti, V, Cr)

Ab initio molecular dynamics model for density, elastic properties and short range order of Co-Fe-Ta-B metallic glass thin films

Ab initio study of effects of substitutional additives on the phase stability of γ-alumina.

Amorphous-crystalline transition in thermoelectric NbO2

Atomistic Modeling-Based Design of Novel Materials

Bonding and classification of nanolayered ternary carbides

Bonding and elastic properties of amorphous AlYB14

Combinatorial evaluation of phase formation and magnetic properties of FeMnCoCrAl high entropy alloy thin film library.

Correlative plasma-surface model for metastable Cr-Al-N: Frenkel pair formation and influence of the stress state on the elastic properties

Coulomb-potential-dependent decohesion of Magnéli phases

Critical evaluation of the colossal Seebeck coefficient of nanostructured rutile MnO2.

Crystallite size-dependent metastable phase formation of TiAlN coatings

Deformation behavior of Re alloyed Mo thin films on flexible substrates: In situ fragmentation analysis supported by first-principles calculations

Determining the Elasticity of Materials Employing Quantum-mechanical Approaches: From the Electronic Ground State to the Limits of Materials Stability

Development of thin film cathodes for lithium-ion batteries in the material system Li–Mn–O by r.f. magnetron sputtering

Effect of Si additions on thermal stability and the phase transition sequence of sputtered amorphous alumina thin films

Effect of chemical composition, defect structure, and stress state on the elastic properties of (V1-x Al x )1-y N y

Elastic properties of amorphous T 0.75Y0.75B14 (T = Sc, Ti, V, Y, Zr, Nb) and the effect of O incorporation on bonding, density and elasticity (T' = Ti, Zr).

Elastic properties of face-centred cubic Fe–Mn–C studied by nanoindentation and ab initio calculations

Elastic properties of fcc Fe-Mn-X (X = Cr, Co, Ni, Cu) alloys studied by the combinatorial thin film approach and ab initio calculations

Electronic hybridisation implications for the damage-tolerance of thin film metallic glasses

Electronic structure and elastic properties of Y(n+1)Co(3n+5)B(2n) ([Formula: see text]).

Electronic structure tuning of the anomalous thermoelastic behavior in Nb- X ( X = Zr, V, Mo) solid solutions

Equilibrium structure of δ-Bi(2)O(3) from first principles.

First Principles Investigation of Anomalous Pressure-Dependent Thermal Conductivity of Chalcopyrites

From qualitative to quantitative description of the anomalous thermoelastic behavior of V, Nb, Ta, Pd and Pt

From quantum to continuum mechanics: studying the fracture toughness of transition metal nitrides and oxynitrides

High-throughput exploration of thermoelectric and mechanical properties of amorphous NbO2 with transition metal additions

Influence of Si and N additions on structure and phase stability of Ge(2)Sb(2)Te(5) thin films

Kinetically Limited Phase Formation of Pt-Ir Based Compositionally Complex Thin Films

Modeling of metastable phase formation diagrams for sputtered thin films

Molecular Coverage Determines Sliding Wear Behavior of n-Octadecylphosphonic Acid Functionalized Cu-O Coated Steel Disks against Aluminum

Nanometre-scale 3D defects in Cr2AlC thin films.

On the solubility of yttrium in RuO2

Origin of the nitrogen over- and understoichiometry in Ti(0.5)Al(0.5)N thin films.

Phase stability of AlYB(14) sputtered thin films

Quantum mechanically guided design of Co43Fe20Ta(5.5)X(31.5) (X=B, Si, P, S) metallic glasses

Recent progress and new directions in density functional theory based design of hard coatings

Revealing the relationships between chemistry, topology and stiffness of ultrastrong Co-based metallic glass thin films: A combinatorial approach

Stability, elastic properties and fracture toughness of Al0.75X0.75B14 (X=Sc, Ti, V, Cr, Y, Zr, Nb, Mo) investigated using ab initio calculations.

Stiffness and toughness prediction of Co–Fe–Ta–B metallic glasses, alloyed with Y, Zr, Nb, Mo, Hf, W, C, N and O by ab initio molecular dynamics

Structural transformation of sputtered o-LiMnO2 thin-film cathodes induced by electrochemical cycling

Synthesis and mechanical properties of Fe–Nb–B thin-film metallic glasses

Synthesis of Intermetallic (Mg1-x,Alx)2Ca by Combinatorial Sputtering

Synthesis, microstructure, and mechanical properties of YPd3B thin films

Systematic study on the electronic structure and mechanical properties of X2BC (X = Mo, Ti, V, Zr, Nb, Hf, Ta and W).

Systematic study on the pressure dependence ofM2AlCphases(M=Ti,V,Cr,Zr,Nb,Mo,Hf,Ta,W)

The correlation between the electronic structure and elastic properties of nanolaminates

The influence of additions of Al and Si on the lattice stability of fcc and hcp Fe-Mn random alloys

Theoretical study of phase stability and elastic properties of T 0.75Y0.75B14 (T = Sc, Ti, V, Y, Zr, Nb, Si).

Thermal expansion of Pd-based metallic glasses by ab initio methods and high energy X-ray diffraction

Thermal stability of Ti3SiC2 thin films

Thermodynamic and Electrochemical Properties of the Li–Co–O and Li–Ni–O Systems

Thermodynamic description of the LiNiO2–NiO2 pseudo-binary system and extrapolation to the Li(Co,Ni)O2–(Co,Ni)O2 system

Thermodynamic description of the layered O3 and O2 structural LiCoO2–CoO2 pseudo-binary systems

Topology and electronic structure of flexible (Nb,Ru)O2 thermoelectrics

Tuneable thermal expansion of poly (3,4-ethylenedioxythiophene) polystyrene sulfonate

Ultra-stiff metallic glasses through bond energy density design

Vacancy filling effect in thermoelectric NbO.