Search Results - "Goddard, W"
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Nanometallic Glasses: Size Reduction Brings Ductility, Surface State Drives Its Extent
Published in Nano letters (11-09-2013)“…We report tensile experiments on Ni80P20 metallic glass samples fabricated via a templated electroplating process and via focused ion beam milling, which…”
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Quantum Chemical Calculations of the Influence of Anchor-Cum-Spacer Groups on Femtosecond Electron Transfer Times in Dye-Sensitized Semiconductor Nanocrystals
Published in Journal of chemical theory and computation (01-03-2006)“…Electronic properties of dye-sensitized semiconductor nanocrystals, consisting of perylene (Pe) chromophores attached to 2 nm TiO2 nanocrystals via different…”
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3
Direct MD Simulations of Terahertz Absorption and 2D Spectroscopy Applied to Explosive Crystals
Published in The journal of physical chemistry letters (06-03-2014)“…A direct molecular dynamics simulation of the THz spectrum of a molecular crystal is presented. A time-dependent electric field is added to a molecular…”
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4
Hildebrand and Hansen solubility parameters from Molecular Dynamics with applications to electronic nose polymer sensors
Published in Journal of computational chemistry (30-11-2004)“…We introduce the Cohesive Energy Density (CED) method, a multiple sampling Molecular Dynamics computer simulation procedure that may offer higher consistency…”
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5
Ductility and work hardening in nano-sized metallic glasses
Published in Applied physics letters (09-02-2015)“…In-situ nano-tensile experiments on 70 nm-diameter free-standing electroplated NiP metallic glass nanostructures reveal tensile true strains of ∼18%, an amount…”
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6
Current perspectives of the roles of the central norepinephrine system in anxiety and depression
Published in Depression and anxiety (01-04-2010)“…Norepinephrine (NE) is a major monoamine neurotransmitter that has widespread effects across multiple brain areas to regulate arousal and stress responses. The…”
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7
Tensile Strength of Liquids: Equivalence of Temporal and Spatial Scales in Cavitation
Published in The journal of physical chemistry letters (03-03-2016)“…It is well known that strain rate and size effects are both important in material failure, but the relationships between them are poorly understood. To…”
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Decreased GABA levels in anterior cingulate cortex/medial prefrontal cortex in panic disorder
Published in Progress in neuro-psychopharmacology & biological psychiatry (01-07-2013)“…Changes of various brain metabolites including γ-aminobutyric acid (GABA), measured by 1H-magnetic resonance spectroscopy (MRS), have been reported in panic…”
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9
Computational modeling of structure-function of g protein-coupled receptors with applications for drug design
Published in Current medicinal chemistry (01-04-2010)“…G protein-coupled receptors (GPCRs) mediate senses such as odor, taste, vision, and pain in mammals. In addition, important cell recognition and communication…”
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10
Growth and Isolation of Large Area Boron‐Doped Nanocrystalline Diamond Sheets: A Route toward Diamond‐on‐Graphene Heterojunction
Published in Advanced functional materials (17-01-2019)“…Many material device applications would benefit from thin diamond coatings, but current growth techniques, such as chemical vapor deposition (CVD) or atomic…”
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On interplay of surface tension and inertial stabilization mechanisms in the stable and unstable interface dynamics with the interfacial mass flux
Published in Physica scripta (01-08-2021)“…Non-equilibrium dynamics of interfaces and mixing are omnipresent in fluids, plasmas and materials, in nature and technology, at astrophysical and at molecular…”
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12
The Neurobiology of Panic: A Chronic Stress Disorder
Published in Chronic Stress (2017)“…Panic disorder is an often chronic and impairing human anxiety syndrome, which frequently results in serious psychiatric and medical comorbidities. Although,…”
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Multicenter, randomized, double-blind, active comparator and placebo-controlled trial of a corticotropin-releasing factor receptor-1 antagonist in generalized anxiety disorder
Published in Depression and anxiety (01-05-2010)“…Background: Antagonism of corticotropin‐releasing factor (CRF) receptors has been hypothesized as a potential target for the development of novel anxiolytics…”
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14
Stability of an accelerated hydrodynamic discontinuity
Published in Europhysics letters (01-01-2019)“…We analyze from a far field the evolution of an accelerated interface separating ideal incompressible fluids of different densities. We develop and apply a…”
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15
Antibody Catalysis of the Oxidation of Water
Published in Science (American Association for the Advancement of Science) (07-09-2001)“…Recently we reported that antibodies can generate hydrogen peroxide (H2O 2) from singlet molecular oxygen (1O 2 *). We now show that this process is catalytic,…”
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16
Modeling the effects of fertilizer application rate on nitrous oxide emissions
Published in Soil Science Society of America journal (01-01-2006)“…The attribution of N2O emission factors to N inputs from chemical fertilizers requires an understanding of how those inputs affect the biological processes…”
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Serotoninergic mechanisms in the treatment of obsessive–compulsive disorder
Published in Drug discovery today (01-04-2008)“…Obsessive–compulsive disorder (OCD) is a disabling psychiatric condition affecting 1–2% of the community. Although modern drug, behavioral and psychosurgical…”
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Trends in Use and Cost of Second-Generation Antipsychotics Among Children and Teens in Indiana Medicaid, 2004–2012
Published in Psychiatric Services (01-09-2016)“…Objective:To replicate and extend a study by the Agency for Healthcare Research and Quality (AHRQ) and Rutgers on antipsychotic use among youths in Medicaid,…”
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UFF, a full periodic table force field for molecular mechanics and molecular dynamics simulations
Published in Journal of the American Chemical Society (01-12-1992)Get full text
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20
Predicting Solid-State Heats of Formation of Newly Synthesized Polynitrogen Materials by Using Quantum Mechanical Calculations
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (20-11-2008)“…We present density functional theory level predictions and analysis of the basic properties of newly synthesized high-nitrogen compounds together with…”
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