Assessment of self-consistent field convergence in spin-dependent relativistic calculations Fulltext Access 7 Pages 2016
Amino-terminated diamond surfaces: Photoelectron emission and photocatalytic properties Fulltext Access 7 Pages 2016
Exploring the incorporation of nitrogen in titanium and its influence on the electrochemical corrosion resistance in acidic media Fulltext Access 7 Pages 2016
Formaldehyde adsorption and decomposition on rutile (110): A first-principles study Fulltext Access 7 Pages 2016
High-resolution angle-resolved photoemission investigation of potassium and phosphate tungsten bronzes Fulltext Access 7 Pages 2016
Electronic polarons, cumulants and doubly dynamical mean field theory: Theoretical spectroscopy for correlated and less correlated materials Fulltext Access 7 Pages 2016
Fast transport of water molecules across carbon nanotubes induced by static electric fields Fulltext Access 7 Pages 2016
Dissipative Particle Dynamics interaction parameters from ab initio calculations Fulltext Access 7 Pages 2016
New findings on the influence of carbon surface curvature on energetics of benzene adsorption from gaseous phase Fulltext Access 7 Pages 2016
Gaussian-based range-separation approach on Hartree-Fock exchange interaction and second-order perturbation theory Fulltext Access 7 Pages 2016
Do large polycyclic aromatic hydrocarbons and graphene bend? How popular theoretical methods complicate finding the answer to this question Fulltext Access 7 Pages 2016
Selective oxidation of cyclohexene through gold functionalized silica monolith microreactors Fulltext Access 7 Pages 2016
Experimental and modeling approaches for the formation of hydroperoxide during the auto-oxidation of polymers: Thermal-oxidative degradation of polyethylene oxide Fulltext Access 7 Pages 2016
Research paperA new version of fermion coupled coherent states method: Theory and applications in simulation of two-electron systems Fulltext Access 7 Pages 2016
Synthesis of nanoscale silicon oxide oxidation state distributions: The transformation from hydrophilicity to hydrophobicity Fulltext Access 7 Pages 2016
Proton transfer pathways in an aspartate-water cluster sampled by a network of discrete states Fulltext Access 7 Pages 2016
Formation of regular polyicosahedral structure during growth of large Lennard-Jones clusters from their global minimum Fulltext Access 7 Pages 2016
Line shape in a free-jet hypersonic expansion investigated by cavity ring-down spectroscopy and computational fluid dynamics Fulltext Access 7 Pages 2016
Dewetting dynamics of nickel thin film on alpha-quartz substrate: A molecular dynamics study Fulltext Access 7 Pages 2016
Computational study of interfacial charge transfer complexes of 2-anthroic acid adsorbed on a titania nanocluster for direct injection solar cells Fulltext Access 7 Pages 2016
Influence of the potential model parameters on the structures and potential energy surface of cobalt clusters Fulltext Access 7 Pages 2016
Time-dependent renormalized Redfield theory II for off-diagonal transition in reduced density matrix Fulltext Access 7 Pages 2016
Effect of heterocycles on field-effect transistor performances of donor-acceptor-donor type small molecules Fulltext Access 7 Pages 2016
Orientation dependences of surface morphologies and energies of iron-gallium alloys Fulltext Access 7 Pages 2016
Color change mechanism of niobium oxide thin film with incidental light angle and applied voltage Fulltext Access 7 Pages 2016
Engineering organic/inorganic alumina-based films as dielectrics for red organic light emitting transistors Fulltext Access 7 Pages 2016
Palladium catalyst synthesis through sol-gel processing for electroless nickel deposition on glass Fulltext Access 7 Pages 2016
A complete residual stress model for laser surface hardening of complex medium carbon steel components Fulltext Access 7 Pages 2016
Electrodeposition of nanocrystalline zinc on steel for enhanced resistance to corrosive wear Fulltext Access 7 Pages 2016
Multifunctional durable properties of textile materials modified by biocidal agents in the sol-gel process Fulltext Access 7 Pages 2016
High performance inverted polymer solar cells with solution processed metal oxides as electron transport layers: A comparative study Fulltext Access 7 Pages 2016
Electro-oxidation of polyaniline in the presence of electronic acceptors and the magnetic properties of the resulting polyaniline Fulltext Access 7 Pages 2016
Elucidating the influences of mechanical bending on charge transport at the interfaces of organic light-emitting diodes Fulltext Access 7 Pages 2016
Effects of Cr interlayer thickness on adhesive, structural, and thermoelectric properties of antimony telluride thin films deposited by radio-frequency magnetron sputtering Fulltext Access 7 Pages 2016
Effect of the oxidation of aluminum bottom electrode in a functionalized-carbon nanotube based organic rewritable memory device Fulltext Access 7 Pages 2016
Synthesis of reduced graphene oxide sheets decorated by zinc oxide nanoparticles: Crystallographic, optical, morphological and photocatalytic study Fulltext Access 7 Pages 2016
Chemically modified Si(111) surfaces simultaneously demonstrating hydrophilicity, resistance against oxidation, and low trap state densities Fulltext Access 7 Pages 2016
The preparation and chemical reaction kinetics of tungsten bronze thin films and nitrobenzene with and without a catalyst Fulltext Access 7 Pages 2016
Synthesis and characterization of bifunctional surfaces with tunable functional group pairs Fulltext Access 7 Pages 2016
The surface of iron molybdate catalysts used for the selective oxidation of methanol Fulltext Access 7 Pages 2016
Roles of oxygen for methanol adsorption on polycrystalline copper surface revealed by sum frequency generation imaging microscopy Fulltext Access 7 Pages 2016
Charge-transfer dynamics in azobenzene alkanethiolate self-assembled monolayers on gold Fulltext Access 7 Pages 2016
Electrodeposited reduced-graphene oxide/cobalt oxide electrodes for charge storage applications Fulltext Access 7 Pages 2016
Building high-coverage monolayers of covalently bound magnetic nanoparticles Fulltext Access 7 Pages 2016
Study on the interfacial adhesion property of low-k thin film by the surface acoustic waves with cohesive zone model Fulltext Access 7 Pages 2016
Synthesis and electrochemical performance of ruthenium oxide-coated carbon nanofibers as anode materials for lithium secondary batteries Fulltext Access 7 Pages 2016
Printed biotin-functionalised polythiophene films as biorecognition layers in the development of paper-based biosensors Fulltext Access 7 Pages 2016
Laser textured superhydrophobic surfaces and their applications for homogeneous spot deposition Fulltext Access 7 Pages 2016
Effects of glycine and current density on the mechanism of electrodeposition, composition and properties of Ni-Mn films prepared in ionic liquid Fulltext Access 7 Pages 2016
Enhanced electron field emission properties of diamond/microcrystalline graphite composite films synthesized by thermal catalytic etching Fulltext Access 7 Pages 2016
Synthesis of polymeric fluorescent brightener based on coumarin and its performances on paper as light stabilizer, fluorescent brightener and surface sizing agent Fulltext Access 7 Pages 2016
Atomic layer deposition of cobalt carbide films and their magnetic properties using propanol as a reducing agent Fulltext Access 7 Pages 2016
Effects of surface treating methods of high-strength carbon fibers on interfacial properties of epoxy resin matrix composite Fulltext Access 7 Pages 2016
Electrochemical sensing of glucose by reduced graphene oxide-zinc ferrospinels Fulltext Access 7 Pages 2016
Surface modification of magnesium hydroxide using vinyltriethoxysilane by dry process Fulltext Access 7 Pages 2016
Effect of multiple passes treatment in waterjet peening on fatigue performance Fulltext Access 7 Pages 2016
Formation of boron nitride coatings on silicon carbide fibers using trimethylborate vapor Fulltext Access 7 Pages 2016
Charge transfer of edge states in zigzag silicene nanoribbons with Stone-Wales defects from first-principles Fulltext Access 7 Pages 2016
Storage capacity and oxygen mobility in mixed oxides from transition metals promoted by cerium Fulltext Access 7 Pages 2016
Electro-adsorption of tetracycline from aqueous solution by carbonized pomelo peel and composite with aniline Fulltext Access 7 Pages 2016
Charge mobility increase in indium-molybdenum oxide thin films by hydrogen doping Fulltext Access 7 Pages 2016
Role of crystal orientation on chemical mechanical polishing of single crystal copper Fulltext Access 7 Pages 2016
Highly dispersed silica-supported ceria-zirconia nanocomposites: Preparation and characterization Fulltext Access 7 Pages 2016
Electrophoretic deposition of spherical carbonyl iron particles on carbon fibers as a microwave absorbent composite Fulltext Access 7 Pages 2016
Applying electrohydrodynamic atomization to enhance mass transfer of metal salts from an aqueous phase towards ionic liquids Fulltext Access 7 Pages 2016
On the origin of enhanced electrochemical behavior of oxidized activated carbon Fulltext Access 7 Pages 2016
Relativistic frozen core potential scheme with relaxation of core electrons Fulltext Access 7 Pages 2016
Evidence for reduced charge recombination in carbon nanotube/perovskite-based active layers Fulltext Access 7 Pages 2016
Research paperWetting and evaporation of argon nanodroplets on smooth and rough substrates: Molecular dynamics simulations Fulltext Access 7 Pages 2016
Excited-state symmetry breaking of linear quadrupolar chromophores: A transient absorption study Fulltext Access 7 Pages 2016
Non-linear modelling of the effects of strain on transition metal surfaces Fulltext Access 7 Pages 2016
Measurement of intrinsic and laser heating-induced stress in microcrystalline silicon thin films Fulltext Access 7 Pages 2016
Effect of the N-terminal residues on the quaternary dynamics of human adult hemoglobin Fulltext Access 7 Pages 2016
Internal rotation for predicting conformational population of 1,2-difluorethane and 1,2-dichloroethane Fulltext Access 7 Pages 2016
Fast solute diffusivity in ionic liquids with silyl or siloxane groups studied by the transient grating method Fulltext Access 7 Pages 2016
Molecular dynamics simulations of temperature-dependent structures and dynamics of ethylammonium nitrate protic ionic liquid: The role of hydrogen bond Fulltext Access 7 Pages 2016
Electrical energy harvesting from water droplets passing a hydrophobic polymer with a metal film on its back side Fulltext Access 7 Pages 2016
Four-electron model for singlet and triplet excitation energy transfers with inclusion of coherence memory, inelastic tunneling and nuclear quantum effects Fulltext Access 7 Pages 2016
Theoretical investigation of the long-lived metastable AlO2+ dication in gas phase Fulltext Access 7 Pages 2016
Chirality effect on nearly half-metallic properties in systematic endo-doping of 3d transition metals of narrow carbon nanotubes Fulltext Access 7 Pages 2016
Gas adsorption, energetics and electronic properties of boron- and nitrogen-doped bilayer graphenes Fulltext Access 7 Pages 2016
Effect of periodic potential on exciton states in semiconductor carbon nanotubes Fulltext Access 7 Pages 2016
On the accuracy of the noninteracting electron approximation for vibrationally coupled electron transport Fulltext Access 7 Pages 2016
Role of bonding mechanisms during transfer hydrogenation reaction on heterogeneous catalysts of platinum nanoparticles supported on zinc oxide nanorods Fulltext Access 7 Pages 2016
Morphological and mechanical analysis of electrospun shape memory polymer fibers Fulltext Access 7 Pages 2016
Fabrication of biomimetic superhydrophobic steel surface under an oxygen rich environment Fulltext Access 7 Pages 2016
The evolution of structure and defects in the implanted Si surface: Inspecting by reflective second harmonic generation Fulltext Access 7 Pages 2016
Microstructure and property of diamond-like carbon films with Al and Cr co-doping deposited using a hybrid beams system Fulltext Access 7 Pages 2016