Donald W. Brenner
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Donald W. Brennerchemistry Degrees
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Chemistry Physics
Donald W. Brenner's Degrees
- PhD Physics University of California, Berkeley
- Masters Physics University of California, Berkeley
- Bachelors Physics University of California, Berkeley
Why Is Donald W. Brenner Influential?
(Suggest an Edit or Addition)Donald W. Brenner'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
- A second-generation reactive empirical bond order (REBO) potential energy expression for hydrocarbons (2002) (3139)
- Molecular Simulation of the Influence of Chemical Cross-Links on the Shear Strength of Carbon Nanotube-Polymer Interfaces (2002) (629)
- High-entropy high-hardness metal carbides discovered by entropy descriptors (2018) (433)
- Mechanical and Electrical Properties of Nanotubes (2002) (353)
- Atomistic modeling of the fracture of polycrystalline diamond (2000) (352)
- The stress–strain behavior of polymer–nanotube composites from molecular dynamics simulation (2003) (337)
- Handbook of Nanoscience, Engineering, and Technology (2002) (335)
- Phase stability and mechanical properties of novel high entropy transition metal carbides (2019) (308)
- There's Plenty of Room at the Bottom: An Invitation to Enter a New Field of Physics (2007) (252)
- Colloidal stability of modified nanodiamond particles (2009) (213)
- The Art and Science of an Analytic Potential (2000) (212)
- Charge‐Induced Disorder Controls the Thermal Conductivity of Entropy‐Stabilized Oxides (2018) (212)
- Influence of Chemisorption on the Thermal Conductivity of Single-Wall Carbon Nanotubes (2004) (201)
- Carbon nanostructures for advanced composites (2006) (197)
- Predictions of Enhanced Chemical Reactivity at Regions of Local Conformational Strain on Carbon Nanotubes: Kinky Chemistry (1999) (188)
- Mechanical properties of nanotubule fibers and composites determined from theoretical calculations and simulations (1998) (177)
- Molecular Dynamics Simulations of Dimer Opening on a Diamond {001}(2x1) Surface (1992) (162)
- Molecular dynamics simulations of the nanometer-scale mechanical properties of compressed Buckminsterfullerene (1991) (160)
- Local structure of the MgxNixCoxCuxZnxO(x=0.2) entropy‐stabilized oxide: An EXAFS study (2017) (130)
- Carbon Nanostructures (2002) (130)
- Simulations of buckminsterfullerene (C60) collisions with a hydrogen-terminated diamond {111} surface (1991) (118)
- Simulated Tribochemistry: An Atomic-Scale View of the Wear of Diamond (1994) (109)
- Investigation of the atomic-scale friction and energy dissipation in diamond using molecular dynamics (1995) (97)
- On the way to fullerenes : molecular dynamics study of the Curling and closure of graphitic ribbons (1992) (95)
- Nanoscale investigation of indentation, adhesion and fracture of diamond (111) surfaces (1992) (95)
- Charge compensation and electrostatic transferability in three entropy-stabilized oxides: Results from density functional theory calculations (2016) (92)
- Effect of atomic-scale surface roughness on friction: a molecular dynamics study of diamond surfaces (1993) (91)
- Geometric and electronic structures of C60H60, C60F60, and C60H36 (1991) (88)
- Effects of chemically bound, flexible hydrocarbon species on the frictional properties of diamond surfaces (1993) (84)
- Tribological properties of polyalphaolefin oil modified with nanocarbon additives (2015) (70)
- Compression-induced structural transition in a self-assembled monolayer (1994) (69)
- Flow control through polymer-grafted smart nanofluidic channels: molecular dynamics simulations. (2005) (69)
- Would Diamond Nanorods Be Stronger than Fullerene Nanotubes (2003) (69)
- The Electrical Engineering Handbook Series (2004) (68)
- Molecular dynamics simulations of friction in self-assembled monolayers (1994) (68)
- Atomic scale simulations of ductile failure micromechanisms in nanocrystalline Cu at high strain rates (2009) (67)
- Atomic scale studies of spall behavior in nanocrystalline Cu (2010) (66)
- Local Density Functional Electronic Structures of Three Stable Icosahedral Fullerenes (1991) (62)
- Ion Pickup of Large, Surface-Adsorbed Molecules: A Demonstration of the Eley-Rideal Mechanism (1992) (61)
- Predicted structure and electronic properties of individual carbon nanocones and nanostructures assembled from nanocones (2001) (57)
- Stimuli-Responsive Polymer Brushes for Flow Control through Nanopores (2012) (57)
- On the disclination-structural unit model of grain boundaries (2000) (56)
- Thermal conductivity of diamond nanorods: Molecular simulation and scaling relations. (2006) (52)
- Strengthening mechanisms in nanocrystalline alloys (2008) (52)
- Free energies of (Co, Fe, Ni, Zn)Fe2O4 spinels and oxides in water at high temperatures and pressure from density functional theory: results for stoichiometric NiO and NiFe2O4 surfaces (2013) (50)
- Symmetric Isomers of Hydrofullerene C60H36 (1994) (49)
- Evidence for Jahn-Teller compression in the (Mg, Co, Ni, Cu, Zn)O entropy-stabilized oxide: A DFT study (2018) (49)
- Simulations of self-assembled monolayers under compression : effect of surface asperities (1994) (48)
- Atomistic Simulations of Friction at Sliding Diamond Interfaces (1993) (47)
- Atomistic mechanisms of adhesion and compression of diamond surfaces (1991) (47)
- Three decades of many-body potentials in materials research (2012) (44)
- Atomistic simulation of the influence of pre-existing stress on the interpretation of nanoindentation data (2004) (43)
- Atomistic simulations of the nanometer-scale indentation of amorphous-carbon thin films (1997) (43)
- The adsorption of aflatoxin B1 by detonation-synthesis nanodiamonds (2007) (42)
- Immobilization of mycotoxins on modified nanodiamond substrates. (2011) (42)
- Handbook of Nanoscience, Engineering, and Technology, Second Edition (2007) (40)
- Simulated engineering of nanostructures (1996) (38)
- Molecular Dynamics Simulations of Carbon Nanotube Rolling and Sliding on Graphite (2000) (37)
- Surface patterning by atomically-controlled chemical forces : molecular dynamics simulations (1994) (37)
- Multiscale modeling approach for calculating grain-boundary energies from first principles (1998) (36)
- Tersoff-Type Potentials for Carbon, Hydrogen and Oxygen (1988) (35)
- The role of creep in the time-dependent resistance of Ohmic gold contacts in radio frequency microelectromechanical system devices (2008) (35)
- ATOMISTIC SIMULATIONS OF STRUCTURES AND MECHANICAL PROPERTIES OF POLYCRYSTALLINE DIAMOND : SYMMETRICAL (001) TILT GRAIN BOUNDARIES (1999) (35)
- ATOMISTIC SIMULATIONS OF STRUCTURES AND MECHANICAL PROPERTIES OF (011) TILT GRAIN BOUNDARIES AND THEIR TRIPLE JUNCTIONS IN DIAMOND (1999) (34)
- Electron and phonon thermal conductivity in high entropy carbides with variable carbon content (2020) (34)
- Influence of mass and charge disorder on the phonon thermal conductivity of entropy stabilized oxides determined by molecular dynamics simulations (2019) (31)
- Calculated Stability and Structure of Nickel Ferrite Crystal Surfaces in Hydrothermal Environments (2014) (31)
- Atomic-Scale Simulation of Tribological and Related Phenomena (1998) (31)
- Influence of Pb segregation on the deformation of nanocrystalline Al: Insights from molecular simulations (2008) (31)
- Bonding and Stability of Hybrid Diamond/Nanotube Structures (2003) (31)
- Tension―compression asymmetry in nanocrystalline Cu: High strain rate vs. quasi-static deformation (2010) (30)
- MICROSCOPIC MECHANISMS OF REACTIONS ASSOCIATED WITH SILICON MBE: A MOLECULAR DYNAMICS INVESTIGATION (1988) (30)
- Chemical Dynamics and Bond-Order Potentials. (1996) (30)
- Hydrogen Raman shifts in carbon nanotubes from molecular dynamics simulation (2001) (30)
- Electrostatically mediated adsorption by nanodiamond and nanocarbon particles (2012) (29)
- Jetting and Detonation Initiation in Shock Induced Collapse of Nanometer-Scale Voids (2008) (29)
- HYDROGEN ABSTRACTION FROM A DIAMOND SURFACE. AB INITIO QUANTUM CHEMICAL STUDY WITH CONSTRAINED ISOBUTANE AS A MODEL (1991) (29)
- Carbon Nanostructures: Morphologies and Properties (2007) (29)
- Reinforcement Mechanisms in Polymer Nanotube Composites: Simulated Non-Bonded and Cross-Linked Systems (2000) (29)
- Ad hoc continuum-atomistic thermostat for modeling heat flow in molecular dynamics simulations (2005) (29)
- Atomic Modeling of Carbon-Based Nanostructures as a Tool for Developing New Materials and Technologies (2002) (27)
- Toward Designing Smart Nanovalves: Modeling of Flow Control through Nanopores via the Helix-Coil Transition of Grafted Polypeptide Chains (2007) (27)
- Kinetic energy enhanced molecular beam epitaxial growth of Si{100} (1988) (26)
- Electron emission properties of detonation nanodiamonds (2004) (26)
- TEMPERATURE-DEPENDENT FUSION OF COLLIDING C60 FULLERENES FROM MOLECULAR DYNAMICS SIMULATIONS (1995) (24)
- First-principles investigation of the structure and synergistic chemical bonding of Ag and Mg at the Al | Ω interface in a Al–Cu–Mg–Ag alloy (2009) (24)
- Atomistic modeling of the segregation of lead impurities to a grain boundary in an aluminum bicrystalline solid (2008) (24)
- A continuum-atomistic method for incorporating Joule heating into classical molecular dynamics simulations (2005) (23)
- Fluorescent dye adsorption on nanocarbon substrates through electrostatic interactions (2010) (23)
- Computational study of the impurity induced reduction of grain boundary energies in nano- and bi-crystalline Al–Pb alloys (2010) (22)
- An angular-dependent embedded atom method (A-EAM) interatomic potential to model thermodynamic and mechanical behavior of Al/Si composite materials (2012) (22)
- Integrated Experimental, Atomistic, and Microstructurally Based Finite Element Investigation of the Dynamic Compressive Behavior of 2139 Aluminum (2009) (22)
- First principles prediction of the gas-phase precursors for AlN sublimation growth. (2004) (21)
- High-Entropy Ultra-High-Temperature Borides and Carbides: A New Class of Materials for Extreme Environments (2021) (21)
- Quantum‐Based Analytic Interatomic Forces and Materials Simulation (2007) (20)
- Electronic properties of diamond clusters: self-consistent tight binding simulation (2004) (20)
- Elastic models of symmetrical ä001ã and ä011ã tilt grain boundaries in diamond (2000) (20)
- Computational Modeling of Nanometer-Scale Tribology (2005) (19)
- Molecular simulation of the influence of interface faceting on the shock sensitivity of a model plastic bonded explosive. (2008) (19)
- Tribological properties of nanodiamonds in aqueous suspensions: effect of the surface charge (2015) (19)
- Vibrational Properties and Specific Heat of Ultrananocrystalline Diamond: Molecular Dynamics Simulations (2011) (18)
- Diffusion on a self-assembled monolayer: molecular modeling of a bound + mobile lubricant. (2006) (18)
- Fullerene/Tubule Based Hollow Carbon Nano-Gears (1994) (18)
- Simulated thermal decomposition and detonation of nitrogen cubane by molecular dynamics. (2007) (18)
- Atomic-Scale Study of Plastic-Yield Criterion in Nanocrystalline Cu at High Strain Rates (2010) (17)
- Computer Simulations of Nanometer-Scale Indentation and Friction (2010) (17)
- Detonation Initiation from Spontaneous Hotspots Formed During Cook-Off Observed in Molecular Dynamics Simulations (2011) (17)
- Deformation mechanisms of an Ω precipitate in a high-strength aluminum alloy subjected to high strain rates (2011) (16)
- Entropy Landscaping of High‐Entropy Carbides (2021) (16)
- Exchange interactions and long-range magnetic order in the (Mg,Co,Cu,Ni,Zn)O entropy-stabilized oxide: A theoretical investigation (2020) (16)
- Settling the matter of the role of vibrations in the stability of high-entropy carbides (2021) (15)
- Self-Organized Nanostructures (2012) (15)
- The Stress-strain Behavior of Polymer-Nanotube Composites from Molecular Dynamics Simulations (2002) (15)
- Comparison of ab Initio and Empirical Potentials for H-Atom Association with Diamond Surfaces (1996) (15)
- Computational study of nanometer-scale self-propulsion enabled by asymmetric chemical catalysis. (2009) (14)
- STM, QCM, and the windshield wiper effect: a joint theoretical-experimental study of adsorbate mobility and lubrication at high sliding rates. (2006) (14)
- Atomistic Simulation of the Nanoindentation of Diamond and Graphite Surfaces (1991) (14)
- Multiscale analysis of liquid lubrication trends from industrial machines to micro-electrical-mechanical systems. (2007) (13)
- Carbon based nanostructures: diamond clusters structured with nanotubes (2003) (13)
- Molecular Dynamics Simulations of Polymer-Nanotube Composites (1999) (12)
- Atomic and multi-scale modeling of non-equilibrium dynamics at metal–metal contacts (2010) (12)
- Coupled molecular dynamics/continuum simulations of Joule heating and melting of isolated copper–aluminum asperity contacts (2008) (12)
- Defect formation in aqueous environment: Theoretical assessment of boron incorporation in nickel ferrite under conditions of an operating pressurized-water nuclear reactor (PWR) (2015) (12)
- First-principles investigation of boron defects in nickel ferrite spinel (2014) (12)
- Interdependent Roles of Electrostatics and Surface Functionalization on the Adhesion Strengths of Nanodiamonds to Gold in Aqueous Environments Revealed by Molecular Dynamics Simulations. (2018) (11)
- Carbon Family at the Nanoscale (2005) (11)
- Theory and modelling of diamond fracture from an atomic perspective (2015) (11)
- Nanodiamond-based oil lubricants on steel-steel and stainless steel - hard alloy high load contact: investigation of friction surfaces (2014) (10)
- Chemical forces associated with deuterium confinement in palladium. Technical report No. 3, 1 December 1988-28 August 1989 (1989) (10)
- On the Origin and Energy of Triple Junction Defects Due to the Finite Length of Grain Boundaries (2003) (10)
- Atomistic Simulation of Grain Boundaries, Triple Junctions and Related Disclinations (2002) (10)
- Molecular dynamics simulations of deformation in nanocrystalline Al-Pb alloys (2008) (10)
- Combining Molecular Dynamics and Monte Carlo Simulations to Model Chemical Vapor Deposition: Application to Diamond (1992) (9)
- Challenges to marrying atomic and continuum modeling of materials (2013) (9)
- Detonations at Nanometer Resolution Using Molecular Dynamics [Phys. Rev. Lett. 70, 2174 (1993)] (1996) (9)
- Diffusion-accomodated rigid-body translations along grain boundaries in nanostructured materials (2003) (9)
- High-entropy ceramics: Propelling applications through disorder (2021) (9)
- Molecular Basis for Neurofilament Heavy Chain Side Arm Structure Modulation by Phosphorylation (2010) (9)
- Virtual Molecular Design of an Environment-Responsive Nanoporous System (2002) (9)
- First-principles-based mesoscale modeling of the solute-induced stabilization of 〈1 0 0〉 tilt grain boundaries in an Al–Pb alloy (2011) (8)
- SIMULATIONS OF CHEMICALLY-SUSTAINED SHOCK FRONTS IN A MODEL ENERGETIC MATERIAL (1992) (8)
- Incorporation of Reactive Dynamics in Simulations of Chemically-Sustained Shock Waves (1989) (8)
- Modeling the growth of semiconductor epitaxial films via nanosecond time scale molecular dynamics simulations (1991) (8)
- Molecular Dynamics Analysis of Shock Phenomena (1998) (8)
- First-principles investigation of diffusion and defect properties of Fe and Ni in Cr2O3 (2018) (8)
- First principles calculations predict stable 50 nm nickel ferrite particles in PWR coolant (2014) (7)
- Chemistry and phase transitions from hypervelocity impacts (1994) (7)
- Convergence Acceleration Scheme for Self-consistent Orthogonal-basis-set Electronic Structure Methods (2003) (7)
- Molecular dynamics simulations of shock-induced chemistry: application to chemically sustained shock waves (1993) (7)
- Ab initio study of the role of entropy in the kinetics of acetylene production in filament-assisted diamond growth environments. (2006) (7)
- A self-consistent tight binding model for hydrocarbon systems: application to quantum transport simulation (2004) (7)
- Atomistic simulations of diamond films (1992) (7)
- Gas‐Surface Reactions: Molecular Dynamics Simulations of Real Systems (1990) (6)
- Tuning friction and slip at solid-nanoparticle suspension interfaces by electric fields (2019) (6)
- Nanodiamonds for Detoxification (2007) (6)
- MOLECULAR POTENTIALS FOR SIMULATING SHOCK-INDUCED CHEMISTRY (1992) (6)
- Nanotribological Performance Factors for Aqueous Suspensions of Oxide Nanoparticles and Their Relation to Macroscale Lubricity (2019) (6)
- Multiscale Modeling of Metal-Metal Contact Dynamics under High Electromagnetic Stress: Timescales and Mechanisms for Joule Melting of Al-Cu Asperities (2008) (6)
- Interplay of electronic structure and unusual development in crystal structure of YbAuIn and Yb3AuGe2In3 (2015) (6)
- Continuum-atomistic modeling of shock dynamics using a bridging scale decomposition scheme: proof of principle in one dimension. (2007) (5)
- Properties of Polycrystalline Diamond: Multiscale Modeling Approach (2000) (5)
- Computer Modeling of Nanostructured Materials (2007) (5)
- Influence of trace precursors on mass transport and growth rate during sublimation deposition of AlN crystal (2006) (5)
- Hotspot Formation in Shock-Induced Void Collapse (2008) (5)
- Theoretical assessment of bonaccordite formation in pressurized water reactors (2016) (5)
- Molecular-Dynamics Simulations of Collisions of Buckminsterfullerene with Diamond Surfaces (1990) (5)
- Molecular Dynamics Simulations of Plastic Damage in Metals (2014) (5)
- Negative Surface Energies of Nickel Ferrite Nanoparticles under Hydrothermal Conditions (2019) (5)
- Ab initio investigation of the surface properties of austenitic Fe-Ni-Cr alloys in aqueous environments (2017) (5)
- Dissociative phase transitions from hypervelocity impacts (1992) (5)
- Dynamic Failure Behavior of Nanocrystalline Cu at Atomic Scales (2011) (4)
- New Method for Extracting Diffusion-Controlled Kinetics from Differential Scanning Calorimetry: Application to Energetic Nanostructures (2015) (4)
- A particle assembly/constrained expansion (PACE) model for the formation and structure of porous metal oxide deposits on nuclear fuel rods in pressurized light water reactors (2015) (4)
- Hierarchical modeling of nanoindentation and microstructural evolution of face-centered cubic gold aggregates (2007) (4)
- Nanodiamond-based Nanolubricants: Experiment and Modeling (2014) (4)
- Coexistence Of Two Carbon Phases At Grain Boundaries In Polycrystalline Diamond (1996) (4)
- Geometric and Electronic Structures of C60H60, C60F60, and C60H36. (1991) (4)
- What drives adsorption of ions on surface of nanodiamonds in aqueous solutions? (2021) (4)
- Statistical approach to obtaining vacancy formation energies in high-entropy crystals from first principles calculations: Application to a high-entropy diboride (2020) (4)
- Observation of Nanometer-Scale Rolling Motion Mediated by Commensurate Contact (2000) (4)
- Possidle Isomers and Electronic Structure of C 60 H 36 (1990) (3)
- Model for the influence of boron impurities on the morphology of AlN grown by physical vapor transport (2004) (3)
- An Evaluation of Atomic Force Microscopy as a Probe of Nanoscale Residual Stress Via Atomistic Simulation (1998) (3)
- Dynamics of Neutral and Charged Nanodiamonds in Aqueous Media Confined between Gold Surfaces under Normal and Shear Loading (2020) (3)
- Nanostructural Architectures from Molecular Building Blocks (2002) (3)
- Self-consistent tight binding model adapted for hydrocarbon systems (2005) (3)
- Tuning friction at material-nanoparticle-liquid interfaces with an external electric field (2019) (3)
- Dielectric and Electrostatic Properties of the Silica Nanoparticle–Water Interface by EPR of pH-Sensitive Spin Probes (2019) (3)
- Impacts of surface chemistry and adsorbed ions on dynamics of water around detonation nanodiamond in aqueous salt solutions (2021) (3)
- Properties of Novel Fullerene Tubule Structures: A Computational Study (1994) (3)
- Atomic-Scale Simulation of Tribological and Related Phenomena (2020) (3)
- Large-scale molecular dynamics study of amorphous carbon and graphite on parallel machines (1995) (3)
- Nanoindentation as a Probe of Nanoscale Residual Stresses: Atomistic Simulation Results (2000) (3)
- Electronic Structure of Fullerene Tubules (1992) (3)
- Tight Binding Modeling of Properties Related to Field Emission from Nanodiamond Clusters (2000) (3)
- Understanding the Atomic-Level Chemistry and Structure of Oxide Deposits on Fuel Rods in Light Water Nuclear Reactors Using First Principles Methods (2016) (2)
- Limits of chemical effects on cold fusion (1990) (2)
- Modified Nanodiamonds for Adsorption of Propidium Iodide and Aflatoxin (2009) (2)
- Statistical and image analysis for characterizing simulated atomic-scale damage in crystals (2017) (2)
- Dissociative Phase Transitions, Split Shock Waves, Rarefaction Shocks, and Detonations (1992) (2)
- Ion Beam Damage of Polymer Surfaces: Insights from Molecular-Dynamics Simulation (1996) (2)
- Molecular dynamics simulations of the nanometer-scale mechanical properties of compressed (2002) (2)
- Delayed Initiation in a Model Energetic Material (1992) (2)
- Atomic scale simulations of orientation of loading axis on the growth of voids at the onset of ductile failure in single crystal Cu (2008) (2)
- How predictable is plastic damage at the atomic scale (2017) (2)
- Atomistic computer simulations of the reactive dynamics of diamond surfaces (1990) (2)
- Contributions of Molecular Modeling to Nanometer-Scale Science and Technology (2002) (2)
- Mysteries of Friction and Wear Unfolding: CMS Advances the Field of Tribology (2001) (2)
- First Principles Prediction of Gas-Phase Composition and Substrate Temperature for Diamond Film Growth (2000) (1)
- Spatial prediction of crystalline defects observed in molecular dynamic simulations of plastic damage (2017) (1)
- Mechanisms of Molecular Beam Epitaxial Growth on Reconstructed Si{100}: Thermal and Energized Beams (1988) (1)
- D-D (H-H) Interactions within the Interstices of Pd (1991) (1)
- Dynamics of solitary waves induced by shock impulses in a linear atomic chain (1990) (1)
- Nanotribological Properties of Positively and Negatively charged nanodiamonds as additives to solutions (2013) (1)
- Kenny B. Lipkowitz (ed): Reviews in computational chemistry, Volume 27 (2011) (1)
- Symmetric Isomers of CaHx (1994) (1)
- First-principles investigation of boron incorporation into CRUD under Pressurized Water Reactor conditions (2014) (1)
- MODIFICATION OF SURFACE AND THE PHYSICOCHEMICAL PROPERTIES OF NANODIAMONDS Electron Emission Properties of Detonation Nanodiamonds 1 (2004) (1)
- Atomistic modeling of grain boundary fracture in diamond (1998) (1)
- Shark Skin Separation Control (2012) (1)
- Atomistic insights into hydrogen bonds of water around detonation nanodiamonds: effects of surface chemistry and dissolved ions (2021) (1)
- Using First Principles Thermodynamics to Predict the Shape Surface Structure and Reactivity of Solvated Nanoparticles at High Temperatures and Pressures. (2013) (1)
- The Effects of Precipitates and Mn-bearing Particles on the High Strain-Rate Compression of High Strength Aluminum (2009) (1)
- Nanocomputer Architectronics and Nanotechnology (2002) (1)
- A Look Inside Nanotechnology (2002) (1)
- Simulations of Ozone Detonation Using a Reactive Empirical Bond Order (REBO) Potential for the Oxygen System (1995) (1)
- ATOMISTIC STUDIES OF VOID‐GROWTH BASED YIELD CRITERIA IN SINGLE CRYSTAL CU AT HIGH STRAIN RATES (2009) (1)
- Chemical model for intrinsic detonation velocities (2009) (1)
- Modeling of Nanoindentation and Microstructural Ductile Behavior in Metallic Material Systems (2004) (1)
- Relative Energetics of C 44 Fullerene Isomers (1992) (1)
- The Vibrational Properties of Ultrananocrystalline Diamond Based on Molecular dynamics Simulations (2012) (1)
- High-entropy high-hardness metal carbides discovered by entropy descriptors (2018) (1)
- Summary Abstract: Molecular dynamics studies of dynamical processes on the silicon {100} reconstructed surface (1987) (1)
- Science of entropy-stabilized ultra-high temperature thin films: Synthesis, validation and properties (2017) (0)
- Effects of crystal orientation on the properties of a chemically sustained shock wave in a model energetic material (2008) (0)
- Slmulatlomr of Cbo Collisions wlth a Hydrogen-Terminated Dlamond {I 11) Surface (1991) (0)
- Effect of water chemistry on the composition of oxides formed on stainless steel surfaces in light water reactors (2019) (0)
- Manipulation and Assembly (2012) (0)
- MEMS Lubrication: An Atomistic Perspective of a Bound + Mobile Lubricant (2007) (0)
- Understanding the Atomic-Level Chemistry and Structure of Oxide Deposits on Fuel Rods in Light Water Nuclear Reactors Using First Principles Methods (2016) (0)
- Nanoelectronic Circuit Architectures (2002) (0)
- First principles computational descriptor for entropy forming ability (2017) (0)
- Reflecting (on) the Nucleation Curve: Negative Surface Energy Stabilizes Nickel Ferrite Nano-Particles in Nuclear Reactor Coolant (2015) (0)
- MOLECULAR DYNAMICS SIMULATIONS OF PRESSURE WAVE EFFECTS AT VOIDS IN A MODEL CONDENSED-PHASE MATERIAL (1992) (0)
- Quartz Crystal Microbalance Studies of Temperature Rise in a Sliding Contact (2008) (0)
- MEMS Tribology in Extreme Environments. (2007) (0)
- Nanodiamond Particles: Properties and Perspectives for Bioapplications .................................................................................. Amanda M. Schrand, Suzanne A. Cian Hens, and Olga A. Shenderova (2018) (0)
- Submicron Structures in Nature (2012) (0)
- Influence of chemical disorder on atomic structure in high-entropy diborides (2017) (0)
- Molecular Dynamics Studies of the Adatom Induced Rearrangement of the Silicon {100} Surface (1987) (0)
- Molecular Electronic Computing Architectures (2002) (0)
- Silica Gel Processing (2012) (0)
- Limits of chemical effects on cold fusion. Interim technical report, No. 9, 1 Oct 89-30 Sep 90 (1990) (0)
- Short Term Innovative Research Program: Nanoengineered Reactive Materials for Tunable Ignition and Energy Release (2009) (0)
- Virtual Symmetric Charge Transfer Superconducting Pairing Excitations in C60 (1992) (0)
- Biologically Mediated Assembly of Artificial Nanostructures and Microstructures (2002) (0)
- Science of entropy-stabilized ultra-high temperature materials: predictive and multi-physics modelling (2017) (0)
- Molecular and Nanoelectronics (2012) (0)
- The Challenges of Modeling Defect Behavior and Plasticity across Spatial and Temporal Scales: A Case Study of Metal Bilayer Impact (2022) (0)
- Surface Energy Density (2012) (0)
- Joint Experimental-Modeling Study of Tribocontact for Benzene Films on Copper (2004) (0)
- Molecular-Dynamics Simulations of C 60 /He Collisions (1992) (0)
- Special C 44 Isomers (1994) (0)
- Prediction of Energies of Tilt Boundaries in Al-Pb Alloy (2007) (0)
- Influence of mass and charge disorder on the phonon thermal conductivity of some high entropy ceramics by molecular dynamics simulation (2017) (0)
- Observation of tribo-induced melting of an asperity contact with STM-QCM (2007) (0)
- Symmetric Isomers of C60H36. (1994) (0)
- Simulations of Reactive Collisions in Detonating Solids (1989) (0)
- Erratum: Atomistic simulations of structures and mechanical properties of polycrystalline diamond: Symmetrical 〈001〉 tilt grain boundaries [Phys. Rev. B60, 7043 (1999)] (2000) (0)
- Carbon Nanostructures and Nanocomposites (2012) (0)
- Characterization of the thermal properties of entropy stabilized oxides and high entropy diborides (2017) (0)
- Hierarchical Modeling of Failure Mechanisms and Grain-Boundary Effects in Nanocrystalline Aggregates (2005) (0)
- Molecular Dynamics Simulations of Hypervelocity Buckminsterfullerene Collisions (1994) (0)
- General, Unified, Multiscale Modeling to Predict the Sensitivity of Energetic Materials (2011) (0)
- Design and Applications of Photonic Crystals (2002) (0)
- Unraveling micro-mechanisms of grain boundary migration using molecular dynamics simulation and reaction path techniques (2014) (0)
- A Reactive Bond Order Potential for NxHy Species: Molecular Dynamics Simulations of Hydrazine Decomposition (2005) (0)
- Nanotechnology Based Materials and Devices for Health Care (2002) (0)
- Self-Assembled Protein Layers (2012) (0)
- Reactive Nanolaminates with Tailored Yield (2014) (0)
- Tuning friction and rheology at material-nanoparticle-liquid interfaces with an external electric field. (2019) (0)
- Simulations of the Monolayer Lubricants on Solid Surfaces (2005) (0)
- Using spatial cross-correlation image analysis to characterize the influence of strain rate on plastic damage in molecular dynamics simulations (2017) (0)
- New Perturbation Method for Predicting Solute Segregation Energies for Symmetric Tilt Grain Boundaries (2013) (0)
- NanoBio, Medicine, and Life Sciences (2012) (0)
- Friction & Wear Under Very High Electromagnetic Stress (2004) (0)
- The onset of spallation in nanocrystalline copper: An atomic scale study (2009) (0)
- Continuum and Atomistic Modeling of Thin Films Subjected to Nanoindentation (2005) (0)
- Nanomanipulation: Buckling, Transport, and Rolling at the Nanoscale (2002) (0)
- Coupling Classical Molecular Dynamics Simulations to Continuum Current and Heat Flow Equations: Application to Frictional and Resistive Heating of Nanoscale Metal Contacts (2005) (0)
- Study of phase separation and ordering in indium gallium nitride and aluminium indium gallium nitride: experimental and computer modeling (2004) (0)
- Carbon Bonding Controls the Electron and Phonon Thermal Conductivity in High Entropy Carbides (2020) (0)
- Molecular Model for the Interaction of Charged Nano-Diamonds with Metal Surface (2018) (0)
- Modeling the Effect of Varying Electrical Voltage on the Plastic Deformation of a Single Asperity in Hot-Switched RF MEMS Contacts (2008) (0)
- Formulation of an entropy descriptor for entropy stabilized compounds from high-throughput DFT (2017) (0)
- First-Principles Study of Photoexcited Defects in Polysilane Chains (1990) (0)
- The Angular-Dependent Embedded Atom Method: Applications to multi-component interactions in nanocomposites (2010) (0)
- Science of high entropy ultra-high temperature thin films: synthesis and characterization (2017) (0)
- Detonation of solid O3: Effects of void collapse (2008) (0)
- Multiscale Modeling of Metal–Metal Contact Dynamics Under High Electromagnetic Stress: Timescales and Mechanisms for Joule Melting of Al–Cu Asperities (2009) (0)
- Tribological Properties of Motor Oil with Nanodiamond Additive tested for steel friction surfaces with different hardnesses – ERRATUM (2013) (0)
- Studying Motion of 〈100〉 Tilt Grain Boundaries Using Molecular Dynamics Simulation (2014) (0)
- Molecular dynamics of void collapse mechanisms in shocked media (2008) (0)
- WINNERS OF THE FY2005 COMPETITION UNDER THE DEFENSE UNIVERSITY RESEARCH INSTRUMENTATION PROGRAM -- Page 1 of 6 (2005) (0)
- NONLINEAR DYNAMICS OF CHAINS INTERACTING WITH A STEADY SHOCK FRONT (1992) (0)
- Molecular Computing and Processing Platforms (2007) (0)
- Resistance of a Molecule (2002) (0)
- Photoelectron Spectra of C 60 H 36 and C 60 H 60 (1992) (0)
- Some One-Dimensional Molecular Dynamics Simulations of Detonation (1989) (0)
- Novel Simulation Tools for Materials Engineering Education (2000) (0)
- Theoretical assessment of boron incorporation in nickel ferrite under conditions of operating nuclear pressurized water reactors (PWRs) (2014) (0)
- High Strain-Rate Behavior of High Strength Aluminum Alloys (2008) (0)
- High-entropy metal diborides: a new class of ultra-high temperature ceramics (2017) (0)
- Molecular Dynamics Simulation of Atomic-Scale Adhesion, Deformation, Friction, and Modification of Diamond Surfaces (1995) (0)
- Atomistic mechanisms of adhesion and surfaces compression of diamond (1991) (0)
- Measurements and simulations of the phonon thermal conductivity of entropy stabilized alloys (2017) (0)
- Spintronics-Spin-Based Electronics (2002) (0)
- Influence of Processing on the Microstructural Evolution and Multiscale Hardness in Titanium Carbonitrides (TiCN) Produced via Field Assisted Sintering Technology (2023) (0)
- Mechanisms of Organic Molecule Ejection in SIMS and FABMS (1986) (0)
- Phonon scattering mechanisms contributing to the low thermal conductivities of entropy stabilized oxides and high entropy carbides (2018) (0)
- Theory for New Carbon-Based Materials (1992) (0)
- Fixing Interatomic Potentials using Multiscale Modeling: Ad Hoc Schemes for Coupling Atomic and Continuum Simulations (2007) (0)
- Hardening of polymer surfaces by ion irradiation: Insights from computer simulation (1996) (0)
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