| 1 | Mechanical Degradation by Anion Redox in LiNiO2 Countered via Pillaring | 16.3 | 2 | Citations (PDF) |
| 2 | Intrinsic magnetism in semiconducting bulk amorphous tellurium | 3.6 | 1 | Citations (PDF) |
| 3 | Interfacial Challenges of Halide‐Based All‐Solid‐State Batteries | 16.3 | 58 | Citations (PDF) |
| 4 | Sulfur-based hybrid multilayers on Li metal anodes with excellent air stability for ultralong-life and high-performance batteries | 6.7 | 6 | Citations (PDF) |
| 5 | Si-doped HZO and ZrO2 for hysteresis free
high-<i>k</i> dielectric | 1.5 | 2 | Citations (PDF) |
| 6 | Functionalization of Polymer Surfaces for Organic Photoresist Materials | 5.5 | 3 | Citations (PDF) |
| 7 | Transforming Detrimental Crystalline Zinc Hydroxide Sulfate to Homogeneous Fluorinated Amorphous Solid–Electrolyte Interphase on Zinc Anode | 11.5 | 15 | Citations (PDF) |
| 8 | Reaction Mechanisms and Improvement of α-MnO2 Cathode in Aqueous Zn-Ion Battery | 4.6 | 30 | Citations (PDF) |
| 9 | Solid-state quantum defects in wide band-gap two-dimensional silica bilayer | 1.8 | 1 | Citations (PDF) |
| 10 | Rapid synthesis of phase-engineered tungsten carbide electrocatalysts via flash joule heating for high-current-density hydrogen evolution | 6.6 | 8 | Citations (PDF) |
| 11 | 1 +1 > 2 Effect Induced by Space Charge in Solid Electrolytes | 12.4 | 6 | Citations (PDF) |
| 12 | Thermal phonon mechanism of amorphous AlN and thermal transport of thin amorphous layers at the interface | 3.6 | 3 | Citations (PDF) |
| 13 | Ab Initio Design of Pb2+-based Ternary Oxides for Phase Stable and Hole Dopable p-type Oxides | 4.6 | 5 | Citations (PDF) |
| 14 | Mechanism of Fermi Level Pinning for Metal Contacts on Molybdenum Dichalcogenide | 5.5 | 23 | Citations (PDF) |
| 15 | Electron conduction mechanism in indium oxide and its implications for amorphous transport | 2.0 | 3 | Citations (PDF) |
| 16 | First-Principles Understanding on the Formation of Inversion Domain Boundaries of Wurtzite AlN, AlScN, and GaN | 3.3 | 9 | Citations (PDF) |
| 17 | Universal strain engineering for enhancing the hole mobility and dopability in p-type semiconductors | 1.6 | 5 | Citations (PDF) |
| 18 | First principles reaction processes of Co(CO)3NO as an atomic layer deposition precursor on SiO2 and Co surfaces | 1.5 | 1 | Citations (PDF) |
| 19 | An Organic–Inorganic Superlattice with Nanocrystal‐Amorphous Composite Nanolayers for Ultrahigh Thermoelectric Performance | 6.3 | 8 | Citations (PDF) |
| 20 | Oxygen Substitution to Enhance Chemo-Mechanical Stability at the Cathode-Sulfide Electrolyte Interface in All-Solid-State Batteries | 11.5 | 20 | Citations (PDF) |
| 21 | Thermal Transport at the AlN–SiC Interface and Grain Boundary of AlN | 5.5 | 12 | Citations (PDF) |
| 22 | Nearly Barrierless Polarization Switching Mechanisms in ZrO2 Having Perpendicular In-Plane Domain Walls | 5.5 | 3 | Citations (PDF) |
| 23 | Direct Imaging of Asymmetric Interfaces and Electrostatic Potentials inside a Hafnia–Zirconia Ferroelectric Nanocapacitor | 5.5 | 4 | Citations (PDF) |
| 24 | Role of dose optimization in Ru atomic layer deposition for low resistivity films | 1.0 | 6 | Citations (PDF) |
| 25 | Amorphous Ta2SnO6: A hole-dopable p-type oxide | 5.1 | 10 | Citations (PDF) |
| 26 | Non-epitaxial single-crystal 2D material growth by geometric confinement | 30.6 | 202 | Citations (PDF) |
| 27 | First principles study on Li metallic phase nucleation at grain boundaries in a lithium lanthanum titanium oxide (LLTO) solid electrolyte | 6.7 | 6 | Citations (PDF) |
| 28 | DFT modeling of atomic layer deposition of Ru interconnect metal for EUV scaling | 0.8 | 4 | Citations (PDF) |
| 29 | Ilmenite and amorphous SnTiO3 as p-type oxide semiconductors | 3.6 | 10 | Citations (PDF) |
| 30 | Local ordering in Ge/Ge–Sn semiconductor alloy core/shell nanowires revealed by extended x-ray absorption fine structure (EXAFS) | 2.3 | 20 | Citations (PDF) |
| 31 | Effect of Lithium Substitution Ratio of Polymeric Binders on Interfacial Conduction within All-Solid-State Battery Anodes | 5.5 | 9 | Citations (PDF) |
| 32 | Electrochemical Stability and Li Ion Diffusion Kinetics of Grain Boundaries in Li10GeP2S12 Solid Electrolyte | 2.3 | 14 | Citations (PDF) |
| 33 | Implementation of Smart Helmet Based on IOT | 0.1 | 5 | Citations (PDF) |
| 34 | Two types of three-dimensional quantum Hall effects in multilayer
WTe2 | 2.4 | 8 | Citations (PDF) |
| 35 | Contact loss and its improvement at the interface between the cathode and solid electrolyte in all solid-state batteries based on multi-scale and multi-physics analysis | 6.7 | 12 | Citations (PDF) |
| 36 | Suppressing Dendrite Growth and Side Reactions via Mechanically Robust Laponite-Based Electrolyte Membranes for Ultrastable Aqueous Zinc-Ion Batteries | 11.5 | 39 | Citations (PDF) |
| 37 | Density functional theory study on reaction mechanisms of Co(tbu2DAD)2 for area selective-atomic layer deposition of Co films on metal surfaces | 1.5 | 3 | Citations (PDF) |
| 38 | Origins of Fermi Level Pinning for Ni and Ag Metal Contacts on Tungsten Dichalcogenides | 11.5 | 37 | Citations (PDF) |
| 39 | Computational Study for Insight into LixNiO2 Interlayer Collapse and Pillar Dopant to Counter Oxygen Charge-Transfer at High Depth of Charge (x < 0.25) | 0.0 | 0 | Citations (PDF) |
| 40 | Self-Organized Phase-Composite Nanocrystal Solids with Superior Charge Transport | 5.5 | 6 | Citations (PDF) |
| 41 | Atomically Thin Indium-Tin-Oxide Transistors Enabled by Atomic Layer Deposition | 2.2 | 56 | Citations (PDF) |
| 42 | van der Waals 2D metallic materials for low-resistivity interconnects | 3.6 | 10 | Citations (PDF) |
| 43 | Mechanisms for Graphene Growth on SiO2 Using Plasma-Enhanced Chemical Vapor Deposition: A Density Functional Theory Study | 5.5 | 14 | Citations (PDF) |
| 44 | Growth of Ta2SnO6 Films, a Candidate Wide-Band-Gap p-Type Oxide | 2.3 | 18 | Citations (PDF) |
| 45 | Experimental and theoretical determination of the role of ions in atomic layer annealing | 3.6 | 20 | Citations (PDF) |
| 46 | First-principles mobility prediction for amorphous semiconductors | 2.4 | 11 | Citations (PDF) |
| 47 | Investigation of the Resistivity and Emissivity of a Pellicle Membrane for EUV Lithography | 2.7 | 10 | Citations (PDF) |
| 48 | More Powerful Twistron Carbon Nanotube Yarn Mechanical Energy Harvesters | 17.5 | 51 | Citations (PDF) |
| 49 | Interlayer Engineering of Band Gap and Hole Mobility in p-Type Oxide SnO | 5.5 | 35 | Citations (PDF) |
| 50 | Tetravalent Doping in Fluorite-Based Ferroelectric Oxides for Reduced Voltage Operations | 5.5 | 16 | Citations (PDF) |
| 51 | Local Epitaxial Templating Effects in Ferroelectric and Antiferroelectric ZrO2 | 5.5 | 23 | Citations (PDF) |
| 52 | The crucial role of oxygen substitution in argyrodite solid electrolytes from the bulk to the surface under atmospheric conditions | 6.7 | 30 | Citations (PDF) |
| 53 | Remote Oxygen Scavenging of the Interfacial Oxide Layer in Ferroelectric Hafnium–Zirconium Oxide-Based Metal–Oxide–Semiconductor Structures | 5.5 | 32 | Citations (PDF) |
| 54 | Mechanism of mixed conductivity in crystalline and amorphous lithium lanthanum titanate | 2.6 | 7 | Citations (PDF) |
| 55 | Nanometer-Thick Oxide Semiconductor Transistor with Ultra-High Drain Current | 11.5 | 33 | Citations (PDF) |
| 56 | Spin-defect qubits in two-dimensional transition metal dichalcogenides operating at telecom wavelengths | 10.8 | 50 | Citations (PDF) |
| 57 | First Principles Design of High Hole Mobility p-Type Sn–O–X Ternary Oxides: Valence Orbital Engineering of Sn2+ in Sn2+–O–X by Selection of Appropriate Elements X | 4.6 | 44 | Citations (PDF) |
| 58 | Intrinsic enhancement of the rate capability and suppression of the phase transition via p-type doping in Fe–Mn based P2-type cathodes used for sodium ion batteries | 2.0 | 14 | Citations (PDF) |
| 59 | Hafnium–zirconium oxide interface models with a semiconductor and metal for ferroelectric devices | 4.0 | 11 | Citations (PDF) |
| 60 | Cation ordered Ni-rich layered cathode for ultra-long battery life | 22.1 | 189 | Citations (PDF) |
| 61 | Interlayer Design of Pillared Graphite by Na-Halide Cluster Intercalation for Anode Materials of Sodium-Ion Batteries | 3.4 | 8 | Citations (PDF) |
| 62 | Earth‐Abundant Transition Metal‐Based Mullite‐Type Oxide Catalysts for Heterogeneous Oxidation Reactions | 4.1 | 13 | Citations (PDF) |
| 63 | Nonadiabatic dynamics of cobalt tricarbonyl nitrosyl for ligand dissociation induced by electronic excitation | 2.7 | 6 | Citations (PDF) |
| 64 | First-Principles Study on Electron-Induced Excitations of Atomic Layer Deposition Precursors: Inelastic Electron Wave Packet Scattering with Cobalt Tricarbonyl Nitrosyl Co(CO)3NO Using Time-Dependent Density Functional Theory | 1.8 | 4 | Citations (PDF) |
| 65 | Femtosecond Quantum Dynamics of Excited-State Evolution of Halide Perovskites: Quantum Chaos of Molecular Cations | 2.3 | 2 | Citations (PDF) |
| 66 | High-throughput identification of one-dimensional atomic wires and first principles calculations of their electronic states* | 1.1 | 18 | Citations (PDF) |
| 67 | Ambient effect on the Curie temperatures and magnetic domains in metallic two-dimensional magnets | 5.3 | 26 | Citations (PDF) |
| 68 | Unusually High Ion Conductivity in Large-Scale Patternable Two-Dimensional MoS2 Film | 11.5 | 23 | Citations (PDF) |
| 69 | Surface-dependent stress-corrosion cracking in Ni-rich layered oxide cathodes | 7.6 | 38 | Citations (PDF) |
| 70 | Electronic structures and anisotropic carrier mobilities of monolayer ternary metal iodides MLaI
5
(M=Mg, Ca, Sr, Ba) | 1.6 | 2 | Citations (PDF) |
| 71 | A new route of synthesizing atomically thin 2D materials embedded in bulk oxides | 1.6 | 0 | Citations (PDF) |
| 72 | Local epitaxial-like templating effects and grain size distribution in atomic layer deposited Hf0.5Zr0.5O2 thin film ferroelectric capacitors | 2.3 | 25 | Citations (PDF) |
| 73 | Bandgap Tuned WS2 Thin‐Film Photodetector by Strain Gradient in van der Waals Effective Homojunctions | 4.7 | 24 | Citations (PDF) |
| 74 | Core–shell PdAu nanocluster catalysts to suppress sulfur poisoning | 2.0 | 20 | Citations (PDF) |
| 75 | Surface Energy-Driven Preferential Grain Growth of Metal Halide Perovskites: Effects of Nanoimprint Lithography Beyond Direct Patterning | 5.5 | 35 | Citations (PDF) |
| 76 | Why In2O3 Can Make 0.7 nm Atomic Layer Thin Transistors | 6.2 | 226 | Citations (PDF) |
| 77 | Synergistic Catalysis of the Lattice Oxygen and Transition Metal Facilitating ORR and OER in Perovskite Catalysts for Li–O2 Batteries | 9.8 | 98 | Citations (PDF) |
| 78 | Effect of atomic passivation at Ni-MoS2 interfaces on contact behaviors | 2.0 | 7 | Citations (PDF) |
| 79 | Surface and interfacial study of atomic layer deposited Al
2
O
3
on MoTe
2
and WTe
2 | 1.9 | 17 | Citations (PDF) |
| 80 | Transport gaps in ideal zigzag-edge graphene nanoribbons with chemical edge disorder | 5.1 | 6 | Citations (PDF) |
| 81 | Stability of ferroelectric and antiferroelectric hafnium–zirconium oxide thin films | 1.6 | 50 | Citations (PDF) |
| 82 | Dynamic band alignment modulation of ultrathin WOx/ZnO stack for high on/off ratio field-effect switching applications | 3.6 | 1 | Citations (PDF) |
| 83 | Flat Bands and Mechanical Deformation Effects in the Moiré Superlattice of MoS2-WSe2 Heterobilayers | 11.5 | 62 | Citations (PDF) |
| 84 | Giant renormalization of dopant impurity levels in 2D semiconductor MoS2 | 2.7 | 17 | Citations (PDF) |
| 85 | Altered Stability and Degradation Pathway of CH3NH3PbI3 in Contact with Metal Oxide | 12.4 | 82 | Citations (PDF) |
| 86 | Ideal two-dimensional solid electrolytes for fast ion transport: metal trihalides MX3 with intrinsic atomic pores | 3.6 | 12 | Citations (PDF) |
| 87 | Role of Surface Oxygen Vacancies in Intermediate Formation on Mullite-type Oxides upon NO Adsorption | 2.3 | 18 | Citations (PDF) |
| 88 | Reversible Anionic Redox Activities in Conventional LiNi1/3Co1/3Mn1/3O2 Cathodes | 0.9 | 17 | Citations (PDF) |
| 89 | Ideal two-dimensional molecular sieves for gas separation: Metal trihalides MX3 with precise atomic pores | 7.8 | 16 | Citations (PDF) |
| 90 | Regulating the Catalytic Dynamics Through a Crystal Structure Modulation of Bimetallic Catalyst | 16.3 | 42 | Citations (PDF) |
| 91 | Reversible Anionic Redox Activities in Conventional LiNi1/3Co1/3Mn1/3O2 Cathodes | 11.6 | 126 | Citations (PDF) |
| 92 | Real-time ab initio simulation of inelastic electron scattering using the exact, density functional, and alternative approaches | 2.0 | 7 | Citations (PDF) |
| 93 | Two-dimensional nanoporous metal chalcogenophosphates MP2X6 with high electron mobilities | 5.1 | 18 | Citations (PDF) |
| 94 | Integrated Experimental–Theoretical Approach To Determine Reliable Molecular Reaction Mechanisms on Transition-Metal Oxide Surfaces | 5.5 | 12 | Citations (PDF) |
| 95 | Band Structure Engineering of Layered WSe2 via One-Step Chemical Functionalization | 11.5 | 33 | Citations (PDF) |
| 96 | First principles calculations of intrinsic mobilities in tin-based oxide semiconductors SnO, SnO2, and Ta2SnO6 | 1.6 | 81 | Citations (PDF) |
| 97 | Pocketlike Active Site of Rh1/MoS2 Single-Atom Catalyst for Selective Crotonaldehyde Hydrogenation | 11.7 | 210 | Citations (PDF) |
| 98 | Molecularly Thin Electrolyte for All Solid-State Nonvolatile Two-Dimensional Crystal Memory | 6.2 | 12 | Citations (PDF) |
| 99 | Ligand-induced reduction concerted with coating by atomic layer deposition on the example of TiO2-coated magnetite nanoparticles | 5.3 | 13 | Citations (PDF) |
| 100 | Higher superconducting transition temperature by breaking the universal pressure relation | 5.2 | 59 | Citations (PDF) |
| 101 | Stable and Active Oxidation Catalysis by Cooperative Lattice Oxygen Redox on SmMn2O5 Mullite Surface | 11.7 | 107 | Citations (PDF) |
| 102 | Origin of theoretical pseudocapacitance of two-dimensional supercapacitor electrodes Ti3C2T2 (T = bare, O, S) | 6.7 | 53 | Citations (PDF) |
| 103 | A Fermi‐Level‐Pinning‐Free 1D Electrical Contact at the Intrinsic 2D MoS2–Metal Junction | 17.5 | 187 | Citations (PDF) |
| 104 | Superior low-temperature NO catalytic performance of PrMn2O5 over SmMn2O5 mullite-type catalysts | 2.9 | 24 | Citations (PDF) |
| 105 | ZnO composite nanolayer with mobility edge quantization for multi-value logic transistors | 10.8 | 101 | Citations (PDF) |
| 106 | Threshold Voltage Modulation of a Graphene–ZnO Barristor Using a Polymer Doping Process | 3.8 | 17 | Citations (PDF) |
| 107 | Improved carrier doping strategy of monolayer MoS2 through two-dimensional solid electrolyte of YBr3 | 2.3 | 14 | Citations (PDF) |
| 108 | Ab-initio design of novel cathode material LiFeP1-Si O4 for rechargeable Li-ion batteries | 4.1 | 5 | Citations (PDF) |
| 109 | Exploring the microscopic mechanism of pseudocapacitance with electronic structures in monolayer 1T-MoS2 electrodes for supercapacitors | 5.9 | 6 | Citations (PDF) |
| 110 | Unravelling origins of Pd ensembles’ activity in CO oxidation via state-to-state microkinetic analysis | 4.4 | 18 | Citations (PDF) |
| 111 | Critical Role of Mullite-type Oxides’ Surface Chemistry on Catalytic NO Oxidation Performance | 2.3 | 25 | Citations (PDF) |
| 112 | Evaluation of silver -copper-tin brazing alloy corrosion behavior in chloride containing electrolyte at various temperature | 0.3 | 0 | Citations (PDF) |
| 113 | Kinetic Stability of Bulk LiNiO2 and Surface Degradation by Oxygen Evolution in LiNiO2‐Based Cathode Materials | 16.3 | 227 | Citations (PDF) |
| 114 | Tuning the structure of bifunctional Pt/SmMn2O5 interfaces for promoted low-temperature CO oxidation activity | 3.6 | 20 | Citations (PDF) |
| 115 | Study on the Stability of Sulfide Solid-State Electrolyte Based upon Electronic Structure Calculated from First Principles Calculation | 0.0 | 1 | Citations (PDF) |
| 116 | Surface Modulation of PdCu Nanocatalysts Via the Crystal Structure Change for Lithium-Oxygen Battereis | 0.0 | 0 | Citations (PDF) |
| 117 | Understanding of Correlation between Li Diffusion and Local Environments in Solid Electrolyte Based on Kinetic Energy Barriers As Local Structure Variations By First Principles Calculation | 0.0 | 0 | Citations (PDF) |
| 118 | First-principles study of metal-graphene edge contact for ballistic Josephson junction | 1.8 | 1 | Citations (PDF) |
| 119 | Atomic-scale understanding of non-stoichiometry effects on the electrochemical performance of Ni-rich cathode materials | 6.1 | 28 | Citations (PDF) |
| 120 | Atomically thin transition metal layers: Atomic layer stabilization and metal-semiconductor transition | 1.6 | 8 | Citations (PDF) |
| 121 | Mechanism of Phosphorus Transport Through Silicon Oxide During Phosphonic Acid Monolayer Doping | 2.3 | 17 | Citations (PDF) |
| 122 | Tuning the Electronic and Photonic Properties of Monolayer MoS2 via In Situ Rhenium Substitutional Doping | 11.9 | 184 | Citations (PDF) |
| 123 | Quantum-Confined Electronic States Arising from the Moiré Pattern of MoS2–WSe2 Heterobilayers | 6.2 | 112 | Citations (PDF) |
| 124 | 2D MoS2 as an efficient protective layer for lithium metal anodes in high-performance Li–S batteries | 23.4 | 756 | Citations (PDF) |
| 125 | Realizing Large-Scale, Electronic-Grade Two-Dimensional Semiconductors | 11.5 | 240 | Citations (PDF) |
| 126 | Ab Initio Study on Surface Segregation and Anisotropy of Ni-Rich LiNi1–2yCoyMnyO2 (NCM) (y ≤ 0.1) Cathodes | 5.5 | 80 | Citations (PDF) |
| 127 | Effect of R-site element on crystalline phase and thermal stability of Fe substituted Mn mullite-type oxides: R2(Mn1−xFex)4O10−δ (R = Y, Sm or Bi; x = 0, 0.5, 1) | 4.0 | 17 | Citations (PDF) |
| 128 | Atomic Insights into Phase Evolution in Ternary Transition‐Metal Dichalcogenides Nanostructures | 7.3 | 15 | Citations (PDF) |
| 129 | Enhanced photoelectrochemical hydrogen evolution at p-type CuBi2O4 photocathode through hypoxic calcination | 6.6 | 49 | Citations (PDF) |
| 130 | Superior catalytic performance of Mn-Mullite over Mn-Perovskite for NO oxidation | 3.8 | 65 | Citations (PDF) |
| 131 | Electronic structures, magnetic properties and band alignments of 3d transition metal atoms doped monolayer MoS2 | 1.6 | 75 | Citations (PDF) |
| 132 | Polarity governs atomic interaction through two-dimensional materials | 23.7 | 256 | Citations (PDF) |
| 133 | Tuning electronic and magnetic properties of Mn-mullite oxide sub-nanoclusters via MnOn polyhedron units | 2.0 | 5 | Citations (PDF) |
| 134 | GeP3 with soft and tunable bonding nature enabling highly reversible alloying with Na ions | 3.1 | 38 | Citations (PDF) |
| 135 | Physical realization of 2D spin liquid state by
ab initio
design and strain engineering in FeX
3 | 1.6 | 6 | Citations (PDF) |
| 136 | Improved durability of Co3O4 particles supported on SmMn2O5 for methane combustion | 2.9 | 56 | Citations (PDF) |
| 137 | Dislocation driven spiral and non-spiral growth in layered chalcogenides | 3.6 | 37 | Citations (PDF) |
| 138 | Rational design of Na(Li1/3Mn1/2Cr1/6)O2 exhibiting cation–anion-coupled redox reactions with superior electrochemical, thermodynamic, atomic, and chemomechanical properties for advanced sodium-ion batteries | 6.7 | 20 | Citations (PDF) |
| 139 | Core–Shell Nanocomposites for Improving the Structural Stability of Li-Rich Layered Oxide Cathode Materials for Li-Ion Batteries | 5.5 | 34 | Citations (PDF) |
| 140 | Quantum Transport and Band Structure Evolution under High Magnetic Field in Few-Layer Tellurene | 6.2 | 80 | Citations (PDF) |
| 141 | Fundamental mechanisms of fracture and its suppression in Ni-rich layered cathodes: Mechanics-based multiscale approaches | 3.1 | 34 | Citations (PDF) |
| 142 | (Invited) Rational Design of Battery Cathode Materials | 0.0 | 0 | Citations (PDF) |
| 143 | Electromechanical scale-bridging model for piezoelectric nanostructures | 2.3 | 4 | Citations (PDF) |
| 144 | Power characteristics of spinel cathodes correlated with elastic softness and phase transformation for high-power lithium-ion batteries | 6.7 | 13 | Citations (PDF) |
| 145 | Intrinsic Origins of Crack Generation in Ni-rich LiNi0.8Co0.1Mn0.1O2 Layered Oxide Cathode Material | 2.7 | 271 | Citations (PDF) |
| 146 | Electronic transport across metal-graphene edge contact | 2.7 | 4 | Citations (PDF) |
| 147 | Tunable H2 binding on alkaline and alkaline earth metals decorated graphene substrates from first-principles calculations | 6.6 | 22 | Citations (PDF) |
| 148 | New Mo6Te6 Sub‐Nanometer‐Diameter Nanowire Phase from 2H‐MoTe2 | 17.5 | 80 | Citations (PDF) |
| 149 | Ferromagnetic contact between Ni and MoX
2
(X = S, Se, or Te) with Fermi-level pinning | 2.7 | 30 | Citations (PDF) |
| 150 | Energetics of metal ion adsorption on and diffusion through crown ethers: First principles study on two-dimensional electrolyte | 2.6 | 15 | Citations (PDF) |
| 151 | Systematic study of electronic structure and band alignment of monolayer transition metal dichalcogenides in Van der Waals heterostructures | 2.7 | 238 | Citations (PDF) |
| 152 | Rational Design of Na(Li1/3Mn2/3)O2 Operated by Anionic Redox Reactions for Advanced Sodium‐Ion Batteries | 17.5 | 111 | Citations (PDF) |
| 153 | Computational Study of MoS2/HfO2 Defective Interfaces for Nanometer-Scale Electronics | 3.4 | 27 | Citations (PDF) |
| 154 | Hexacyanometallates for sodium-ion batteries: insights into higher redox potentials using d electronic spin configurations | 2.0 | 30 | Citations (PDF) |
| 155 | Intrinsic air stability mechanisms of two-dimensional transition metal dichalcogenide surfaces: basal versus edge oxidation | 2.7 | 126 | Citations (PDF) |
| 156 | Nanopatterning of Group V Elements for Tailoring the Electronic Properties of Semiconductors by Monolayer Doping | 5.5 | 12 | Citations (PDF) |
| 157 | CT-MEAM interatomic potential of the Li-Ni-O ternary system for Li-ion battery cathode materials | 2.6 | 16 | Citations (PDF) |
| 158 | Harvesting electrical energy from carbon nanotube yarn twist | 26.1 | 413 | Citations (PDF) |
| 159 | First principles study of the Mn-doping effect on the physical and chemical properties of mullite-family Al2SiO5 | 2.0 | 5 | Citations (PDF) |
| 160 | Nucleation and growth of WSe
2
: enabling large grain transition metal dichalcogenides | 2.7 | 146 | Citations (PDF) |
| 161 | Structural and electronic phase transitions of MoTe
2
induced by Li ionic gating | 2.7 | 10 | Citations (PDF) |
| 162 | A kinetic Monte Carlo simulation method of van der Waals epitaxy for atomistic nucleation-growth processes of transition metal dichalcogenides | 2.7 | 96 | Citations (PDF) |
| 163 | Electronic structures and band alignments of monolayer metal trihalide semiconductors MX3 | 3.6 | 62 | Citations (PDF) |
| 164 | Site-dependent multicomponent doping strategy for Ni-rich LiNi1−2yCoyMnyO2(y= 1/12) cathode materials for Li-ion batteries | 6.7 | 147 | Citations (PDF) |
| 165 | Investigation of the hydrothermal aging of an Mn-based mullite SmMn2O5 catalyst of NO oxidation | 4.0 | 28 | Citations (PDF) |
| 166 | Phase transformations with stress generations in electrochemical reactions of electrodes: Mechanics-based multiscale model for combined-phase reactions | 3.1 | 11 | Citations (PDF) |
| 167 | Reduction of Fermi level pinning at Au–MoS
2
interfaces by atomic passivation on Au surface | 2.7 | 53 | Citations (PDF) |
| 168 | Obstacles toward unity efficiency of LiNi 1-2x Co x Mn x O 2 (x = 0 ∼ 1/3) (NCM) cathode materials: Insights from ab initio calculations | 6.1 | 71 | Citations (PDF) |
| 169 | Atomic disorders in layer structured topological insulator SnBi2Te4 nanoplates | 6.7 | 26 | Citations (PDF) |
| 170 | Electrostatic Double Layer Flash Memory Based on Two-Dimensional Crystals | 0.0 | 0 | Citations (PDF) |
| 171 | Unusual Conversion-type Lithiation in LiVO3 Electrode for Lithium-Ion Batteries | 4.6 | 33 | Citations (PDF) |
| 172 | Mechanism of Oxygen Vacancy on Impeded Phase Transformation and Electrochemical Activation in Inactive Li2MnO3 | 3.2 | 56 | Citations (PDF) |
| 173 | Atomic Mechanism of Arsenic Monolayer Doping on oxide-free Silicon(111) | 0.8 | 1 | Citations (PDF) |
| 174 | Charge-transfer modified embedded-atom method for manganese oxides: Nanostructuring effects on MnO2 nanorods | 2.6 | 13 | Citations (PDF) |
| 175 | Effects of inclusion size and acicular ferrite on cold cracking for high-strength steel welds of YS 600 MPa grade | 1.8 | 42 | Citations (PDF) |
| 176 | Ammonia modification of oxide-free Si(111) surfaces | 1.5 | 11 | Citations (PDF) |
| 177 | Transition Metal Ordering Optimization for High-Reversible Capacity Positive Electrode Materials in the Li–Ni–Co–Mn Pseudoquaternary System | 2.3 | 26 | Citations (PDF) |
| 178 | Controlling nucleation of monolayer WSe
2
during metal-organic chemical vapor deposition growth | 2.7 | 53 | Citations (PDF) |
| 179 | Tuning electronic transport in epitaxial graphene-based van der Waals heterostructures | 3.6 | 26 | Citations (PDF) |
| 180 | Planar Vacancies in Sn1–xBixTe Nanoribbons | 11.5 | 24 | Citations (PDF) |
| 181 | Conflicting Roles of Anion Doping on the Electrochemical Performance of Li-Ion Battery Cathode Materials | 4.6 | 174 | Citations (PDF) |
| 182 | Effects of synthesis conditions on structure and surface properties of SmMn2O5 mullite-type oxide | 5.1 | 31 | Citations (PDF) |
| 183 | Covalent Nitrogen Doping and Compressive Strain in MoS2 by Remote N2 Plasma Exposure | 6.2 | 401 | Citations (PDF) |
| 184 | Ab initio and kinetic Monte Carlo study of lithium diffusion in LiSi, Li12Si7, Li13Si5 and Li15Si4 | 6.1 | 32 | Citations (PDF) |
| 185 | Design of Surface Doping for Mitigating Transition Metal Dissolution in LiNi0.5Mn1.5O4 Nanoparticles | 4.3 | 40 | Citations (PDF) |
| 186 | Charge Mediated Reversible Metal–Insulator Transition in Monolayer MoTe2 and WxMo1–xTe2 Alloy | 11.5 | 147 | Citations (PDF) |
| 187 | Thermal stability of mulliteRMn2O5(R = Bi, Y, Pr, Sm or Gd): combined density functional theory and experimental study | 1.6 | 26 | Citations (PDF) |
| 188 | Electronic properties of MoS2/MoOx interfaces: Implications in Tunnel Field Effect Transistors and Hole Contacts | 2.7 | 50 | Citations (PDF) |
| 189 | Surface-energy engineered Bi-doped SnTe nanoribbons with weak antilocalization effect and linear magnetoresistance | 3.6 | 17 | Citations (PDF) |
| 190 | Rational design of redox mediators for advanced Li–O2 batteries | 45.1 | 380 | Citations (PDF) |
| 191 | Toward Selective Ultra-High-Vacuum Atomic Layer Deposition of Metal Oxides on Si(100) | 2.3 | 17 | Citations (PDF) |
| 192 | Rational design of common transition metal-nitrogen-carbon catalysts for oxygen reduction reaction in fuel cells | 11.9 | 137 | Citations (PDF) |
| 193 | Design of a p-Type Electrode for Enhancing Electronic Conduction in High-Mn, Li-Rich Oxides | 4.6 | 26 | Citations (PDF) |
| 194 | Monolayer MoS2 Bandgap Modulation by Dielectric Environments and Tunable Bandgap Transistors | 2.7 | 319 | Citations (PDF) |
| 195 | First principles kinetic Monte Carlo study on the growth patterns of WSe
2
monolayer | 2.7 | 95 | Citations (PDF) |
| 196 | Phase Separation and d Electronic Orbitals on Cyclic Degradation in Li–Mn–O Compounds: First-Principles Multiscale Modeling and Experimental Observations | 5.5 | 25 | Citations (PDF) |
| 197 | Underlying mechanisms of the synergistic role of Li2MnO3 and LiNi1/3Co1/3Mn1/3O2 in high-Mn, Li-rich oxides | 2.0 | 23 | Citations (PDF) |
| 198 | Mechanism of Arsenic Monolayer Doping of Oxide-Free Si(111) | 4.6 | 22 | Citations (PDF) |
| 199 | Origin of Indium Diffusion in High-k Oxide HfO2 | 5.5 | 31 | Citations (PDF) |
| 200 | Theoretical Demonstration of the Ionic Barristor | 6.2 | 11 | Citations (PDF) |
| 201 | Bulk-surface relationship of an electronic structure for high-throughput screening of metal oxide catalysts | 5.1 | 8 | Citations (PDF) |
| 202 | Organic–inorganic hybrid semiconductor thin films deposited using molecular-atomic layer deposition (MALD) | 3.6 | 17 | Citations (PDF) |
| 203 | Toward Atomic-Scale Patterned Atomic Layer Deposition: Reactions of Al2O3 Precursors on a Si(001) Surface with Mixed Functionalizations | 2.3 | 19 | Citations (PDF) |
| 204 | Unraveling the Origin of Instability in Ni-Rich LiNi1–2xCoxMnxO2 (NCM) Cathode Materials | 2.3 | 205 | Citations (PDF) |
| 205 | A large-scale simulation method on complex ternary Li–Mn–O compounds for Li-ion battery cathode materials | 2.6 | 13 | Citations (PDF) |
| 206 | Characteristics of Interlayer Tunneling Field-Effect Transistors Computed by a “DFT-Bardeen” Method | 1.9 | 5 | Citations (PDF) |
| 207 | Materials Design on the Origin of Gap States in a High-κ/GaAs Interface | 5.8 | 3 | Citations (PDF) |
| 208 | Mechanochemically Reduced SiO2 by Ti Incorporation as Lithium Storage Materials | 4.3 | 17 | Citations (PDF) |
| 209 | Phase stability of transition metal dichalcogenide by competing ligand field stabilization and charge density wave | 2.7 | 39 | Citations (PDF) |
| 210 | Synthesis of BiVO4@C Core–Shell Structure on Reduced Graphene Oxide with Enhanced Visible‐Light Photocatalytic Activity | 4.3 | 14 | Citations (PDF) |
| 211 | Understanding of Surface Redox Behaviors of Li2MnO3 in Li‐Ion Batteries: First‐Principles Prediction and Experimental Validation | 4.3 | 33 | Citations (PDF) |
| 212 | The origins and mechanism of phase transformation in bulk Li2MnO3: first-principles calculations and experimental studies | 6.7 | 107 | Citations (PDF) |
| 213 | Effects of Interlayer Distance and van der Waals Energy on Electrochemical Activation of Partially Reduced Graphite Oxide | 4.1 | 16 | Citations (PDF) |
| 214 | Carbonation of Wollastonite(001) Competing Hydration: Microscopic Insights from Ion Spectroscopy and Density Functional Theory | 5.5 | 64 | Citations (PDF) |
| 215 | Ab initio study of doping effects on LiMnO2 and Li2MnO3 cathode materials for Li-ion batteries | 6.7 | 139 | Citations (PDF) |
| 216 | First Principles Study of Li-Site Doping Effect on the Properties of LiMnO2 and Li2MnO3 Cathode Materials | 0.5 | 3 | Citations (PDF) |
| 217 | Density Functional Theory Study of the Oxygen Chemistry and NO Oxidation Mechanism on Low-Index Surfaces of SmMn2O5 Mullite | 9.8 | 75 | Citations (PDF) |
| 218 | Theoretical Study of Li-Doped sp2–sp3 Hybrid Carbon Network for Hydrogen Storage | 2.3 | 6 | Citations (PDF) |
| 219 | Surface oxidation energetics and kinetics on MoS2 monolayer | 1.6 | 244 | Citations (PDF) |
| 220 | The effect of point defects and nanoparticles on thermal conductivity of magnesium silicide | 2.6 | 8 | Citations (PDF) |
| 221 | Enhancement of the thermoelectric efficiency of PbTe by selective site doping: Effect of group VA impurities | 2.6 | 8 | Citations (PDF) |
| 222 | Critical Descriptor for the Rational Design of Oxide-Based Catalysts in Rechargeable Li–O2Batteries: Surface Oxygen Density | 4.6 | 64 | Citations (PDF) |
| 223 | Ethylenediamine Grafting on Oxide-Free H-, 1/3 ML F-, and Cl-Terminated Si(111) Surfaces | 4.6 | 29 | Citations (PDF) |
| 224 | First-Principles Study of Crown Ether and Crown Ether-Li Complex Interactions with Graphene | 2.3 | 12 | Citations (PDF) |
| 225 | Anti-fluorite Li6CoO4as an alternative lithium source for lithium ion capacitors: an experimental and first principles study | 6.7 | 94 | Citations (PDF) |
| 226 | Multivalent Li-Site Doping of Mn Oxides for Li-Ion Batteries | 2.3 | 40 | Citations (PDF) |
| 227 | Design of Nickel-rich Layered Oxides Using d Electronic Donor for Redox Reactions | 4.6 | 61 | Citations (PDF) |
| 228 | In Situ TEM Characterization of Shear-Stress-Induced Interlayer Sliding in the Cross Section View of Molybdenum Disulfide | 11.5 | 125 | Citations (PDF) |
| 229 | Formation energy of graphene oxide structures: A molecular dynamics study on distortion and thermal effects | 8.6 | 28 | Citations (PDF) |
| 230 | Multiscale analysis of prelithiated silicon nanowire for Li-ion battery | 2.6 | 37 | Citations (PDF) |
| 231 | Ab-Initio and Experimental Studies of Silicon Dioxide Anode Material for Lithium Ion Battery | 0.0 | 0 | Citations (PDF) |
| 232 | Spurious dangling bond formation during atomically precise hydrogen depassivation lithography on Si(100): The role of liberated hydrogen | 1.0 | 13 | Citations (PDF) |
| 233 | MoS2 functionalization for ultra-thin atomic layer deposited dielectrics | 2.3 | 212 | Citations (PDF) |
| 234 | Phase stability of Li–Mn–O oxides as cathode materials for Li-ion batteries: insights from ab initio calculations | 2.0 | 74 | Citations (PDF) |
| 235 | Electronic properties of InP (001)/HfO2 (001) interface: Band offsets and oxygen dependence | 1.6 | 18 | Citations (PDF) |
| 236 | Grain Boundary Effect on Electrical Transport Properties of Graphene | 2.3 | 85 | Citations (PDF) |
| 237 | Tailoring Thermal Transport Property of Graphene through Oxygen Functionalization | 2.3 | 75 | Citations (PDF) |
| 238 | Selectivity of metal oxide atomic layer deposition on hydrogen terminated and oxidized Si(001)-(2×1) surface | 1.0 | 53 | Citations (PDF) |
| 239 | Crystal structure and multicomponent effects in Tetrahedral Silicate Cathode Materials for Rechargeable Li-ion Batteries | 4.1 | 6 | Citations (PDF) |
| 240 | Behavior of Li defects in solid electrolyte lithium thiophosphate Li7P3S11: A first principles study | 2.6 | 24 | Citations (PDF) |
| 241 | Hole Contacts on Transition Metal Dichalcogenides: Interface Chemistry and Band Alignments | 11.5 | 197 | Citations (PDF) |
| 242 | Realistic Metal–Graphene Contact Structures | 11.5 | 98 | Citations (PDF) |
| 243 | Impact of intrinsic atomic defects on the electronic structure of MoS2monolayers | 1.9 | 302 | Citations (PDF) |
| 244 | Ab initio and kinetic Monte Carlo simulation study of lithiation in crystalline and amorphous silicon | 6.1 | 50 | Citations (PDF) |
| 245 | Origin of Poor Cyclability in Li2MnSiO4 from First-Principles Calculations: Layer Exfoliation and Unstable Cycled Structure | 4.6 | 45 | Citations (PDF) |
| 246 | Modulation of contact resistance between metal and graphene by controlling the graphene edge, contact area, and point defects: An ab initio study | 1.6 | 31 | Citations (PDF) |
| 247 | Atomic Layer Deposition of a High-k Dielectric on MoS2 Using Trimethylaluminum and Ozone | 5.5 | 136 | Citations (PDF) |
| 248 | Energy-filtered cold electron transport at room temperature | 10.8 | 26 | Citations (PDF) |
| 249 | The Unusual Mechanism of Partial Fermi Level Pinning at Metal–MoS2 Interfaces | 6.2 | 789 | Citations (PDF) |
| 250 | Ab Initio Study of H2 Associative Desorption on Ad-Dimer Reconstructed Si(001) and Ge(001)-(2×1) Surfaces | 2.3 | 7 | Citations (PDF) |
| 251 | Point defects in garnet-type solid electrolyte (c-Li7La3Zr2O12) for Li-ion batteries | 2.6 | 46 | Citations (PDF) |
| 252 | Combined effects of defects and hydroxyl groups on the electronic transport properties of reduced graphene oxide | 2.1 | 13 | Citations (PDF) |
| 253 | First Principles and Experimental Study of Phase Transformation Mechanism of Li-Rich Oxide Cathode Material in Li-Ion Battery | 0.0 | 0 | Citations (PDF) |
| 254 | Influences of Dopants on the Properties of LiMnO2 and Li2MnO3 in OLO Cathode for Li Ion Batteries | 0.0 | 0 | Citations (PDF) |
| 255 | Intercalation Induced Stress Effects of the Core-Shell Anode Materials for Lithium Ion Battery | 0.0 | 1 | Citations (PDF) |
| 256 | α-MnO2 Nanowire Catalysts with Ultra-High Capacity and Extremely Low Overpotential in Lithium–air Batteries through Tailored Surface Arrangement | 0.0 | 75 | Citations (PDF) |
| 257 | First Principles and Experimental Study of Surface Redox Reactions in Li2MnO3 | 0.0 | 0 | Citations (PDF) |
| 258 | Investigation of probability of pedestrian crash based on auditory recognition distance due to a quiet vehicle in motor mode | 1.1 | 8 | Citations (PDF) |
| 259 | Monolayer Doping via Phosphonic Acid Grafting on Silicon: Microscopic Insight from Infrared Spectroscopy and Density Functional Theory Calculations | 11.9 | 80 | Citations (PDF) |
| 260 | Band alignment of two-dimensional transition metal dichalcogenides: Application in tunnel field effect transistors | 2.3 | 756 | Citations (PDF) |
| 261 | Density functional theory calculations for the oxygen dissociation on nitrogen and transition metal doped graphenes | 2.0 | 18 | Citations (PDF) |
| 262 | Controlling the Atomic Layer Deposition of Titanium Dioxide on Silicon: Dependence on Surface Termination | 2.3 | 75 | Citations (PDF) |
| 263 | α-MnO2 nanowire catalysts with ultra-high capacity and extremely low overpotential in lithium–air batteries through tailored surface arrangement | 2.0 | 80 | Citations (PDF) |
| 264 | Theoretical Study of sp2-sp3 Hybridized Carbon Network for Li-ion Battery Anode | 2.3 | 16 | Citations (PDF) |
| 265 | Developing Descriptors To Predict Mechanical Properties of Nanotubes | 3.2 | 12 | Citations (PDF) |
| 266 | First-principles calculation of thermal transport in metal/graphene systems | 2.4 | 73 | Citations (PDF) |
| 267 | Interface phenomena between Li anode and lithium phosphate electrolyte for Li-ion battery | 6.1 | 28 | Citations (PDF) |
| 268 | Interfacial bonding and electronic structure of HfO2/GaSb interfaces: A first principles study | 2.3 | 19 | Citations (PDF) |
| 269 | Rapid Selective Etching of PMMA Residues from Transferred Graphene by Carbon Dioxide | 2.3 | 98 | Citations (PDF) |
| 270 | A density-functional theory study of tip electronic structures in scanning tunneling microscopy | 1.9 | 7 | Citations (PDF) |
| 271 | Ionic Transport Properties and Structural Stability of High-Capacity Silicate Cathode Materials for Li-Ion Batteries | 0.5 | 0 | Citations (PDF) |
| 272 | Modulation of Dirac points and band-gaps in graphene via periodic fullerene adsorption | 1.0 | 18 | Citations (PDF) |
| 273 | Study of lithium defects in lithium phosphate and in the interface with metallic Li | 0.1 | 0 | Citations (PDF) |
| 274 | In situ study of the role of substrate temperature during atomic layer deposition of HfO2 on InP | 1.6 | 14 | Citations (PDF) |
| 275 | Indium diffusion through high-k dielectrics in high-k/InP stacks | 2.3 | 34 | Citations (PDF) |
| 276 | In situ study of e-beam Al and Hf metal deposition on native oxide InP (100) | 1.6 | 10 | Citations (PDF) |
| 277 | First principles study on InP (001)-(2 × 4) surface oxidation | 1.6 | 18 | Citations (PDF) |
| 278 | Adsorption and Surface Diffusion of Pt Atoms on Hydroxylated MgO(001) Surfaces | 1.9 | 16 | Citations (PDF) |
| 279 | Ionic Transport Properties and Structural Stability of High-Capacity Silicate Cathode Materials for Li-Ion Batteries | 0.0 | 0 | Citations (PDF) |
| 280 | Stress-diffusion Full Coupled Multiscale Simulation Method for Battery Electrode Design | 0.3 | 2 | Citations (PDF) |
| 281 | Development and Application of Chen-Mobius Lattice Inversion Potential for Pd-Au Alloy | 0.1 | 0 | Citations (PDF) |
| 282 | Ab-initioStudy of Interactions of Gold Atoms with Hydroxylated MgO(001) Surfaces | 1.9 | 17 | Citations (PDF) |
| 283 | Reversible superconductivity in electrochromic indium-tin oxide films | 2.3 | 13 | Citations (PDF) |
| 284 | Atomic and electronic structure of superionic solid electrolyte Li10GeP2S12 | 0.1 | 2 | Citations (PDF) |
| 285 | Photon-Assisted CVD Growth of Graphene Using Metal Adatoms As Catalysts | 2.3 | 4 | Citations (PDF) |
| 286 | CO adsorption on Pt (111) and Pd (111) surfaces: A first-principles based lattice gas Monte-Carlo study | 1.9 | 31 | Citations (PDF) |
| 287 | Density functional theory calculations andab initiomolecular dynamics simulations for diffusion of Li+within liquid ethylene carbonate | 1.5 | 44 | Citations (PDF) |
| 288 | Influence of the exchange-correlation potential on the electrochemical properties of multicomponent silicate cathode materials | 4.1 | 10 | Citations (PDF) |
| 289 | Adaptive neural network based fuzzy control for a smart idle stop and go vehicle control system | 1.1 | 9 | Citations (PDF) |
| 290 | Computational Studies for Reduced Graphene Oxide in Hydrogen-Rich Environment | 1.8 | 14 | Citations (PDF) |
| 291 | Activation of Surface Hydroxyl Groups by Modification of H-Terminated Si(111) Surfaces | 11.7 | 74 | Citations (PDF) |
| 292 | Metal–Graphene–Metal Sandwich Contacts for Enhanced Interface Bonding and Work Function Control | 11.5 | 123 | Citations (PDF) |
| 293 | Thermal conductivity of isotopically modified graphene | 23.7 | 964 | Citations (PDF) |
| 294 | Graphitization of Graphene Oxide with Ethanol during Thermal Reduction | 2.3 | 64 | Citations (PDF) |
| 295 | Ab-initio study of silicon and tin as a negative electrode materials for lithium-ion batteries | 1.8 | 36 | Citations (PDF) |
| 296 | First Principles Modeling Of High-K Dielectric Materials | 0.1 | 0 | Citations (PDF) |
| 297 | Density functional theory calculations for the interaction of Li+ cations and PF6– anions with nonaqueous electrolytes | 0.6 | 12 | Citations (PDF) |
| 298 | Si passivation effects on atomic bonding and electronic properties at HfO2/GaAs interface: A first-principles study | 1.6 | 9 | Citations (PDF) |
| 299 | Sulfur passivation effect on HfO2/GaAs interface: A first-principles study | 2.3 | 25 | Citations (PDF) |
| 300 | The Role of Oxygen during Thermal Reduction of Graphene Oxide Studied by Infrared Absorption Spectroscopy | 2.3 | 921 | Citations (PDF) |
| 301 | Theoretical Study of the Electron Transport in Graphene with Vacancy and Residual Oxygen Defects after High-Temperature Reduction | 2.3 | 32 | Citations (PDF) |
| 302 | Multicomponent Silicate Cathode Materials for Li-Ion Batteries | 0.0 | 0 | Citations (PDF) |
| 303 | First-principles study of GaAs(001)-β2(2×4) surface oxidation | 2.5 | 11 | Citations (PDF) |
| 304 | Reparameterization of the REBO-CHO potential for graphene oxide molecular dynamics simulations | 2.4 | 36 | Citations (PDF) |
| 305 | First principles study of Si etching by CHF3 plasma source | 5.1 | 11 | Citations (PDF) |
| 306 | Study of hydrogen physisorption on nanoporous carbon materials of different origin | 6.6 | 27 | Citations (PDF) |
| 307 | Is interfacial chemistry correlated to gap states for high-k/III–V interfaces? | 2.5 | 63 | Citations (PDF) |
| 308 | Energetics of hydrogen in GeO2, Ge, and their interfaces | 2.3 | 9 | Citations (PDF) |
| 309 | Thermal transport in graphene and effects of vacancy defects | 2.4 | 220 | Citations (PDF) |
| 310 | First-principles study of initial growth of GaXO layer on GaAs-β2(2 × 4) surface and interface passivation by F | 1.6 | 13 | Citations (PDF) |
| 311 | First principles study of electronic structures of dopants in Mg2Si | 0.1 | 6 | Citations (PDF) |
| 312 | First principles study of defects in solid electrolyte lithium thiophosphate Li7P3S11 | 0.1 | 0 | Citations (PDF) |
| 313 | First-principles study of CO oxidation on bismuth-promoted Pt(111) surfaces | 1.6 | 9 | Citations (PDF) |
| 314 | Conduction of Li+ cations in ethylene carbonate (EC) and propylene carbonate (PC): comparative studies using density functional theory | 1.8 | 51 | Citations (PDF) |
| 315 | Improvement in Contact Resistivity to thin film Bi2Te3 | 0.1 | 1 | Citations (PDF) |
| 316 | Oxygen dissociation on nitrogen-doped single wall nanotube: A first-principles study | 2.0 | 67 | Citations (PDF) |
| 317 | Interaction of Li+ ions with ethylene carbonate (EC): Density functional theory calculations | 5.1 | 88 | Citations (PDF) |
| 318 | Origin of HfO2/GaAs interface states and interface passivation: A first principles study | 5.1 | 32 | Citations (PDF) |
| 319 | Unusual infrared-absorption mechanism in thermally reduced graphene oxide | 23.7 | 828 | Citations (PDF) |
| 320 | Impact of Dopants on the PbTe Thermoelectric Efficiency | 0.1 | 0 | Citations (PDF) |
| 321 | Band Offset Control by Interfacial Oxygen Content at GaAs:HfO2 interfaces | 0.1 | 0 | Citations (PDF) |
| 322 | First-principles study of GaAs(001)-β2(2×4) surface oxidation and passivation with H, Cl, S, F, and GaO | 1.6 | 80 | Citations (PDF) |
| 323 | Load transfer between cross-linked walls of a carbon nanotube | 2.4 | 41 | Citations (PDF) |
| 324 | First-principles study of metal–graphene interfaces | 1.6 | 412 | Citations (PDF) |
| 325 | Ab Initio Study of CO Hydrogenation to Oxygenates on Reduced Rh Terraces and Stepped Surfaces | 2.3 | 104 | Citations (PDF) |
| 326 | First-Principles and Quantum Transport Studies of Metal-Graphene End Contacts | 0.1 | 2 | Citations (PDF) |
| 327 | Impact of Interfacial Oxygen Content on Bonding, Stability, Band Offsets, and Interface States of GaAs:HfO2 Interfaces | 2.3 | 85 | Citations (PDF) |
| 328 | The Role of Intercalated Water in Multilayered Graphene Oxide | 11.5 | 414 | Citations (PDF) |
| 329 | First-principles-based embedded atom method for PdAu nanoparticles | 2.4 | 57 | Citations (PDF) |
| 330 | Ab initio study of Al–Ni bilayers on SiO2: Implications to effective work function modulation in gate stacks | 1.6 | 18 | Citations (PDF) |
| 331 | First-principles Study of PdAu Segregation with CO Coverage | 0.1 | 2 | Citations (PDF) |
| 332 | Theoretical and Experimental Study of Tip Electronic Structure in Scanning Tunneling Microscope | 0.1 | 1 | Citations (PDF) |
| 333 | First-Principles study of HfO2/:GaAs interface passivation by Si and Ge | 0.1 | 0 | Citations (PDF) |
| 334 | First Principles Study of Metal/Bi 2 Te 3 Interfaces: Implications to Improve Contact Resistance | 0.1 | 4 | Citations (PDF) |
| 335 | Experimental and Theoretical Study of CO Oxidation on PdAu Catalysts with NO Pulse Effects | 2.2 | 17 | Citations (PDF) |
| 336 | First principles study of Nb–W bilayer metal gate electrode | 2.5 | 1 | Citations (PDF) |
| 337 | Quantitative analysis of microstructural and mechanical behavior for Fe–0.1C–(V, Nb) steels as a function of the final rolling temperature | 5.4 | 21 | Citations (PDF) |
| 338 | MEAM study of carbon atom interaction with Ni nano particle | 1.5 | 32 | Citations (PDF) |
| 339 | Coverage-Dependent CO Adsorption Energy from First-Principles Calculations | 2.3 | 61 | Citations (PDF) |
| 340 | CO-Coverage-Dependent Oxygen Dissociation on Pt(111) Surface | 2.3 | 47 | Citations (PDF) |
| 341 | Electronic structures of zigzag graphene nanoribbons with edge hydrogenation and oxidation | 2.4 | 258 | Citations (PDF) |
| 342 | Density Functional Theory Study of CO Hydrogenation on a MoS2 Surface | 2.3 | 90 | Citations (PDF) |
| 343 | Ozone Adsorption on Graphene: Ab Initio Study and Experimental Validation | 2.3 | 189 | Citations (PDF) |
| 344 | Conformal Al2O3 dielectric layer deposited by atomic layer deposition for graphene-based nanoelectronics | 2.3 | 255 | Citations (PDF) |
| 345 | First principles study of the HfO2∕SiO2 interface: Application to high-k gate structures | 1.6 | 25 | Citations (PDF) |
| 346 | Fluorine incorporation at HfO2∕SiO2 interfaces in high-k metal-oxide-semiconductor gate stacks: Local electronic structure | 2.3 | 20 | Citations (PDF) |
| 347 | First-principles study of work functions of double-wall carbon nanotubes | 2.4 | 84 | Citations (PDF) |
| 348 | Extended embedded-atom method for platinum nanoparticles | 1.5 | 17 | Citations (PDF) |
| 349 | Ab InitioModeling of the Interaction of Electron Beams and Single-Walled Carbon Nanotubes | 5.8 | 31 | Citations (PDF) |
| 350 | First-principles study of the work function of nitrogen doped molybdenum (110) surface | 1.6 | 10 | Citations (PDF) |
| 351 | Ab initio study of metal gate electrode work function | 2.3 | 67 | Citations (PDF) |
| 352 | Hydrogenation of Single-Walled Carbon Nanotubes | 5.8 | 250 | Citations (PDF) |
| 353 | Surface diffusion mechanisms for strain-induced self-assembly | 2.4 | 10 | Citations (PDF) |
| 354 | “Migration energy” for impurity diffusion in crystalline solids: A closer look | 1.6 | 11 | Citations (PDF) |
| 355 | Ab initio study of CNT NO2 gas sensor | 2.0 | 766 | Citations (PDF) |
| 356 | Atomistic Simulation Study of Controlled Nanostructure Patterning | 0.1 | 1 | Citations (PDF) |
| 357 | Diffusion Mechanism for Self Assembly on Inhomogeneously Strained Surfaces | 0.1 | 0 | Citations (PDF) |
| 358 | First Principles Modeling Of High-K Dielectric Materials | 0.1 | 1 | Citations (PDF) |
| 359 | Kinetic Monte Carlo Simulations of Strain-Induced Nanopatterning on Hexagonal Surfaces | 0.1 | 3 | Citations (PDF) |
| 360 | Generalized Chemical Reactivity of Curved Surfaces: Carbon Nanotubes | 6.2 | 202 | Citations (PDF) |
| 361 | Growth and properties of small Co islands on a strained Pt surface | 2.1 | 9 | Citations (PDF) |
| 362 | Surface strain effects on adatom kinetics and self-assembly | 1.5 | 13 | Citations (PDF) |
| 363 | Rapid fabrication of aluminum shoe mold using vacuum sealed casting process | 5.4 | 8 | Citations (PDF) |
| 364 | Effect of composition on vacancy mediated diffusion in random binary alloys: First principles study of the Si1−xGex system | 1.6 | 40 | Citations (PDF) |
| 365 | Nanopatterning of periodically strained surfaces: Predictive kinetic Monte Carlo simulation study | 1.6 | 20 | Citations (PDF) |
| 366 | Curie temperature ofFePt:B2O3nanocomposite films | 2.4 | 55 | Citations (PDF) |
| 367 | Nano Electro Mechanics of Semiconducting Carbon Nanotube | 1.9 | 24 | Citations (PDF) |
| 368 | Critical issues in enhancing brightness in thin film phosphors for flat-panel display applications | 5.1 | 46 | Citations (PDF) |
| 369 | endo-Fullerene and Doped Diamond Nanocrystallite-Based Models of Qubits for Solid-State Quantum Computers | 0.6 | 29 | Citations (PDF) |
| 370 | Computational design of compounds for monolithic integration in optoelectronics | 2.4 | 6 | Citations (PDF) |
| 371 | Ab initiostudy on the molecular recognition by metalloporphyrins: CO interaction with iron porphyrin | 1.5 | 13 | Citations (PDF) |
| 372 | Mechanism for hydrogen-enhanced oxygen diffusion in silicon | 2.4 | 36 | Citations (PDF) |
| 373 | Cation-rich (100) surface reconstructions of InP and GaP | 2.4 | 34 | Citations (PDF) |
| 374 | Deliberately Designed Materials for Optoelectronics Applications | 5.8 | 42 | Citations (PDF) |
| 375 | Semiconductor alloys for monolithic integration with Si microelectronics | 3.9 | 0 | Citations (PDF) |
| 376 | Diffusion of adsorbate atoms on the reconstructed Si(111) surface | 1.5 | 102 | Citations (PDF) |
| 377 | Theory of Adsorption and Desorption ofH2Molecules on the Si(111)-(7×7)surface | 5.8 | 31 | Citations (PDF) |
| 378 | Ab initiostudy of lithium intercalation in metal oxides and metal dichalcogenides | 2.4 | 1,350 | Citations (PDF) |
| 379 | Ab initio study of water hexamer anions | 2.0 | 47 | Citations (PDF) |
| 380 | Intrinsic surface atom manipulations in STM and AFM | 5.1 | 5 | Citations (PDF) |
| 381 | Vicinal Si(100) surfaces under external strain | 2.4 | 11 | Citations (PDF) |
| 382 | The Nature of a Wet Electron | 5.8 | 142 | Citations (PDF) |
| 383 | Ab initiostudies of adatom vacancies on the Si(111)-(7×7) surface | 2.4 | 15 | Citations (PDF) |
| 384 | Flipping silicon dimers on Si(100) using scanning tip microscopy: A theoretical investigation | 2.4 | 23 | Citations (PDF) |
| 385 | Signatures of Bulk and Surface Arsenic Antisite Defects in GaAs(110) | 5.8 | 41 | Citations (PDF) |
| 386 | Ab initiostudy of hydrogen adsorption on the Si(111)-(7×7) surface | 2.4 | 36 | Citations (PDF) |
| 387 | Mechanical hysteresis on an atomic scale | 1.5 | 13 | Citations (PDF) |
| 388 | Adaptive Riemannian metric for all-electron calculations | 2.4 | 32 | Citations (PDF) |
| 389 | Tip-surface interactions in scanning tunneling microscopy | 5.8 | 74 | Citations (PDF) |
| 390 | Constant-temperature molecular dynamics with momentum conservation | 1.5 | 53 | Citations (PDF) |
| 391 | Ergodicity and dynamical properties of constant-temperature molecular dynamics | 1.8 | 39 | Citations (PDF) |
| 392 | The Role of Chloride Ions in the IR > IR * Criterion for Crevice Corrosion in Iron | 2.2 | 46 | Citations (PDF) |
| 393 | Demonstration of Crevice Corrosion in Alkaline Solution Without Acidification | 2.2 | 45 | Citations (PDF) |
| 394 | M4,5N4,5X Auger line shapes of La compounds from one-step model calculations | 2.4 | 5 | Citations (PDF) |
| 395 | Large-change sensitivities of linear digital networks | 1.2 | 16 | Citations (PDF) |
| 396 | Densities and molar volumes of molten rare-earth chlorides: PrCl3, NdCl3, GdCl3 and DyCl3 | 4.1 | 13 | Citations (PDF) |
| 397 | Reassessing the Commercialization of Aqueous Zinc-Ion Batteries Based on Laboratory Achievements | 3.9 | 19 | Citations (PDF) |
| 398 | Direct Writing of Oxygen‐Doped Mo
2
C Enabled by Low‐Temperature Laser Deposition for High‐Performance Acidic Hydrogen Evolution Reaction | 17.5 | 6 | Citations (PDF) |
| 399 | The effect of defects on the formation of inversion domain boundaries in AlScN and their structural/electronic property improvement | 3.6 | 1 | Citations (PDF) |
| 400 | Controlling the p-type conductivity of α-SnO thin films by potassium doping | 2.8 | 1 | Citations (PDF) |
| 401 | Battery safety and security for electric urban air mobility | 2.9 | 6 | Citations (PDF) |
| 402 | Growth of tetragonal PtO by molecular-beam epitaxy and its integration into β-Ga2O3 Schottky diodes | 2.8 | 2 | Citations (PDF) |
| 403 | Non-equilibrium plasma activated durable molybdenum oxycarbide electrocatalysts for acidic hydrogen evolution up to 10 A cm-2 | 10.8 | 1 | Citations (PDF) |
| 404 | Construction of sp2/sp3-mixed carbon/diamond interfaces for advanced energy storage applications | 2.1 | 0 | Citations (PDF) |
| 405 | Oxygen Vacancy Energetics and Kinetics at Hf
0.5
Zr
0.5
O
2
–WO
3
Interfaces: Impact on Ferroelectric Behavior and Device Functionality | 3.3 | 2 | Citations (PDF) |
| 406 | Role of surface states and band modulations in ultrathin ruthenium interconnects | 2.0 | 0 | Citations (PDF) |
| 407 | A cost-competitive amorphous oxychlorophosphate polyanion cluster solid electrolyte for all-solid-state lithium batteries | 11.9 | 0 | Citations (PDF) |
| 408 | Thermodynamically Driven Phase Separation and Heterogeneous Interfacial Fast-Ion Conduction in the NTC-LTC Electrolyte | 0.0 | 0 | Citations (PDF) |
| 409 | Leading the Pack: Next‐Generation Batteries for Humanoid Robotics | 7.7 | 0 | Citations (PDF) |
