- Learning on-top: Regressing the on-top pair density for real-space visualization of electron correlation
2020/10/31 by Alberto Fabrizio, Ksenia R. Briling, David D. Girardier +1 · 1 citation
Chemistry · Materials Science · Physics and Astronomy · #Ab initio #Advanced Chemical Physics Studies #Basis (linear algebra) #Density functional theory #Electron #Electron density #Electronic correlation #Machine Learning in Materials Science #Metric (unit) #Molecular spectroscopy and chirality #Visualization #Wave function
- Observations of the chemical and thermal response of ‘ring rain’ on Saturn’s ionosphere
2018/11/05 by James O’Donoghue, Luke Moore, Jack Connerney +7 · 1 citation
Physics and Astronomy · #Astro and Planetary Science #Astronomy #Astrophysics and Star Formation Studies #Atmosphere (unit) #Atmospheric sciences #Electron density #Environmental science #Geophysics #Ion #Ionization #Ionosphere #Meteorology #Physics #Planet #Planetary Science and Exploration #Plasma #Radiative transfer #Saturn
- Density functional theory is straying from the path toward the exact functional
2017/01/05 by Michael G. Medvedev, Ivan S. Bushmarinov, Иван С. Бушмаринов +4 · 56 citations
Chemical Engineering · Chemistry · Engineering · Physics and Astronomy · #Advanced Chemical Physics Studies #Artificial intelligence #Catalysis and Oxidation Reactions #Chemistry #Computational chemistry #Computer science #Density functional theory #Electron #Electron density #Fidelity #Metric (unit) #Molecular Junctions and Nanostructures #Orbital-free density functional theory #Path (computing) #Perspective (graphical) #Physics #Quantum mechanics #Series (stratigraphy) #Statistical physics #Telecommunications #Theoretical physics #Time-dependent density functional theory
- Observation of the Wigner-Huntington Transition to Solid Metallic Hydrogen
2016/10/05 by Ranga Dias, Isaac F. Silvera · 1 voice · 12 citations
Chemistry · Earth and Planetary Sciences · Physics and Astronomy · #Advanced Chemical Physics Studies #Ambient pressure #Analytical Chemistry (journal) #Atomic physics #Chemistry #Condensed matter physics #Drude model #Electron #Electron density #High-pressure geophysics and materials #Hydrogen #Materials science #Metal #Metallic hydrogen #Metallurgy #Optics #Optoelectronics #Physics #Plasma #Quantum, superfluid, helium dynamics #Reflectivity #Solid hydrogen #Thermodynamics #Visible spectrum #Wavelength #cond-mat.mtrl-sci #cond-mat.other
- Simultaneous Visualization of Covalent and Noncovalent Interactions Using Regions of Density Overlap
2014/06/30 by Piotr de Silva, Clémence Corminbœuf · 2 citations
Chemistry · Computer Science · Materials Science · Mathematics · #Chemical physics #Chemistry #Computational Drug Discovery Methods #Computational chemistry #Computer science #Covalent bond #Crystallography and molecular interactions #Data mining #Electron #Electron density #Hydrogen bond #Machine Learning in Materials Science #Materials science #Mathematics #Molecule #Nanotechnology #Non-covalent interactions #Physics #Quantum mechanics #Scalar (mathematics) #Supramolecular chemistry #Visualization
- MAGNETIC FIELDS IN LARGE-DIAMETER H II REGIONS REVEALED BY THE FARADAY ROTATION OF COMPACT EXTRAGALACTIC RADIO SOURCES
2011/06/05 by L. Harvey-Smith, Lisa Harvey-Smith, Gregory J. Madsen +3 · 1 citation
Physics and Astronomy · #Astrophysics #Astrophysics and Star Formation Studies #Earth's magnetic field #Electron density #Faraday effect #Field strength #Galaxies: Formation, Evolution, Phenomena #L-shell #Line-of-sight #Magnetic field #Physics #Plasma #Stellar, planetary, and galactic studies #astro-ph.GA
- THE GALAXY-WIDE DISTRIBUTIONS OF MEAN ELECTRON DENSITY IN THE H II REGIONS OF M51 AND NGC 4449
2010/01/02 by Leonel Gutiérrez, John E. Beckman, J. E. Beckman · 1 citation
Physics and Astronomy · #Astrophysics #Astrophysics and Star Formation Studies #Dwarf galaxy #Electron #Electron density #Galaxies: Formation, Evolution, Phenomena #Galaxy #Interacting galaxy #Irregular galaxy #Luminosity #Physics #RADIUS #Spiral galaxy #Stellar, planetary, and galactic studies #astro-ph.CO
- 4D attosecond imaging with free electrons: Diffraction methods and potential applications
2009/08/09 by Peter Baum, Ahmed H. Zewail · 1 citation
Biochemistry, Genetics and Molecular Biology · Chemistry · Physics and Astronomy · #Advanced Chemical Physics Studies #Advanced Electron Microscopy Techniques and Applications #Atomic physics #Attosecond #Chemistry #Diffraction #Electron #Electron density #Electron diffraction #Free electron model #Laser #Laser-Matter Interactions and Applications #Matter wave #Optics #Physics #Quantum #Quantum mechanics #Ultrashort pulse #Wavelength
- Thomson scattering system on the TEXTOR tokamak using a multi-pass laser beam configuration
2009/02/26 by M. Yu. Kantor, A. J. H. Donné, R. Jaspers +2 · 1 citation
Physics and Astronomy · #Magnetic confinement fusion research #Ionosphere and magnetosphere dynamics #Laser-Plasma Interactions and Diagnostics #Thomson scattering #Tokamak #Limiter #Laser #Plasma #Optics #Plasma diagnostics #Pedestal #Materials science #Electron temperature #Beam (structure) #Electron density #Physics #Atomic physics #Nuclear physics
- Accurate Molecular Van Der Waals Interactions from Ground-State Electron Density and Free-Atom Reference Data
2009/02/20 by Alexandre Tkatchenko, Matthias Scheffler · 7 citations
Physics and Astronomy · Chemistry · #Advanced Chemical Physics Studies #Quantum, superfluid, helium dynamics #Fullerene Chemistry and Applications #van der Waals force #Van der Waals radius #Intermolecular force #Van der Waals surface #Atom (system on chip) #Physics #Atomic physics #Van der Waals strain #Electron density #Density functional theory #Molecule #Ground state #Electron #Molecular physics #Quantum mechanics
- Localization in an inhomogeneous quantum wire
2008/07/31 by A. D. Güçlü, A. D. Guclu, C. J. Umrigar +3 · 1 citation
Chemistry · Physics and Astronomy · #Advanced Chemical Physics Studies #Chemistry #Condensed matter physics #Coulomb #Coulomb blockade #Electron #Electron density #Ferromagnetism #Monte Carlo method #Physics #Physics of Superconductivity and Magnetism #Polarization (electrochemistry) #Quantum #Quantum Monte Carlo #Quantum and electron transport phenomena #Quantum mechanics #Quantum tunnelling #Quantum wire #cond-mat.mes-hall #cond-mat.str-el
- Carrier Transport in Two-Dimensional Graphene Layers
2006/10/31 by E. H. Hwang, S. Adam, Shaffique Adam +1 · 2 citations
Engineering · Materials Science · Physics and Astronomy · #Asymmetry #Charge-carrier density #Condensed matter physics #Conductivity #Density functional theory #Doping #Electrical resistivity and conductivity #Electron #Electron density #Electron mobility #Graphene #Graphene research and applications #Impurity #Materials science #Nanopore and Nanochannel Transport Studies #Nanotechnology #Optics #Physics #Quantum and electron transport phenomena #Saturation (graph theory) #Scattering #cond-mat.mes-hall
- Tetrahedral structure or chains for liquid water
2006/05/12 by Teresa Head‐Gordon, Margaret E. Johnson · 1 citation
Physics and Astronomy · Chemistry · #Spectroscopy and Quantum Chemical Studies #Advanced Chemical Physics Studies #Quantum, superfluid, helium dynamics #X-ray absorption spectroscopy #Hydrogen bond #Tetrahedron #Asymmetry #Crystallography #Molecule #Scattering #Chemistry #Hydrogen #Liquid water #Electron density #Chemical physics #Spectroscopy #Absorption spectroscopy #Materials science #Electron #Physics #Thermodynamics #Optics #Organic chemistry
- Electron temperatures and densities of planetary nebulae determined from the nebular hydrogen recombination spectrum and temperature and density variations
2004/03/16 by Yong Zhang, Y. Zhang, X. -W. Liu +5 · 1 citation
Physics and Astronomy · #Astronomy #Astrophysics #Astrophysics and Star Formation Studies #Atomic and Molecular Physics #Atomic physics #Balmer series #Doubly ionized oxygen #Electron #Electron density #Electron temperature #Emission spectrum #Galaxy #H II region #Line (geometry) #Physics #Planetary nebula #Spectral line #Star formation #Stars #Stellar, planetary, and galactic studies #astro-ph
- Sunspot plume observations in the EUV
2003/08/01 by J. G. Doyle, M. S. Madjarska · 1 citation
Earth and Planetary Sciences · Physics and Astronomy · #Astrophysics #Atmospheric Ozone and Climate #Electron density #Electron temperature #Ionosphere and magnetosphere dynamics #Magnetic field #Meteorology #Physics #Plasma #Plume #Solar and Space Plasma Dynamics #Sunspot #Turbulence
- Abundances and Physical Conditions in the Interstellar Gas toward HD 192639
2002/05/23 by P. Sonnentrucker, S. D. Friedman, D. E. Welty +2 · 2 citations
Physics and Astronomy · #Astronomy and Astrophysical Research #Astrophysics and Star Formation Studies #Electron density #Hydrogen #Interstellar medium #Ion #Ionization #Line (geometry) #Line-of-sight #Mean kinetic temperature #Photoionization #Spectral line #Stellar, planetary, and galactic studies #astro-ph
- Observations of H \documentclassaastex \usepackageamsbsy \usepackageamsfonts \usepackageamssymb \usepackagebm \usepackagemathrsfs \usepackagepifont \usepackagestmaryrd \usepackagetextcomp \usepackageportland,xspace \usepackageamsmath,amsxtra \usepackage[OT2,OT1]fontenc \newcommand\cyr \renewcommand\rmdefaultwncyr \renewcommand\sfdefaultwncyss \renewcommand\encodingdefaultOT2 \normalfont \selectfont \DeclareTextFontCommand\textcyr\cyr \pagestyleempty \DeclareMathSizes10976 \begindocument \landscape +3 \enddocument in the Diffuse Interstellar Medium
2001/10/30 by B. J. McCall, Benjamin J. McCall, K. H. Hinkle +13 · 4 citations
Chemistry · Earth and Planetary Sciences · Physics and Astronomy · #Analytical Chemistry (journal) #Astrophysics and Star Formation Studies #Atmospheric Ozone and Climate #Atomic physics #Chemistry #Crystallography #Electron #Electron density #Infrared #Infrared spectroscopy #Ion #Ionization #Molecular Spectroscopy and Structure #Optics #Physics #Quantum mechanics #astro-ph
- A novel definition of a molecule in a crystal
1997/03/01 by Mark A. Spackman, Patrick G. Byrom, P. G. Byrom · 28 citations
Chemistry · Physics and Astronomy · #Advanced Chemical Physics Studies #Chemical Thermodynamics and Molecular Structure #Chemical physics #Chemistry #Computer science #Crystal (programming language) #Crystallography #Crystallography and molecular interactions #Electron #Electron density #Formamide #Intermolecular force #Materials science #Molecule #Physics #Quantum mechanics #Superposition principle
- Single-crystal structures and electron density distributions of ethane, ethylene and acetylene. I. Single-crystal X-ray structure determinations of two modifications of ethane
1978/06/01 by G. J. H. van Nes, A. Vos · 1 citation
Chemistry · Materials Science · #Acetylene #Analytical Chemistry (journal) #Catalysis #Chemical Thermodynamics and Molecular Structure #Chemistry #Crystal (programming language) #Crystal structure #Crystallography #Crystallography and molecular interactions #Electron #Electron density #Ethylene #Materials science #Nuclear physics #Organic chemistry #Physics #Single crystal #X-ray #X-ray Diffraction in Crystallography