Citation Impact
Citing Papers
A Stable Binary BeB2 phase
2014
LAMMPS - a flexible simulation tool for particle-based materials modeling at the atomic, meso, and continuum scales
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Crystal Structure of Carbon Dioxide at High Pressure: “Superhard” Polymeric Carbon Dioxide
1999
The Chemical Imagination at Work in Very Tight Places
2007 StandoutNobel
First-principles equation of state of polystyrene and its effect on inertial confinement fusion implosions
2015
“Learn on the Fly”: A Hybrid Classical and Quantum-Mechanical Molecular Dynamics Simulation
2004
Properties of warm dense polystyrene plasmas along the principal Hugoniot
2014
Phonon Dispersion of bcc Iron to 10 GPa
2000
First-principles opacity table of warm dense deuterium for inertial-confinement-fusion applications
2014
Fast and Accurate Modeling of Molecular Atomization Energies with Machine Learning
2012 Standout
Sex differences in aggression between heterosexual partners: A meta-analytic review.
2000 Standout
Effect of Intense Laser Irradiation on the Lattice Stability of Semiconductors and Metals
2006
Ab‐initiosimulations of materials using VASP: Density‐functional theory and beyond
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Gaussian Approximation Potentials: The Accuracy of Quantum Mechanics, without the Electrons
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Complex thermoelectric materials
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Relation of threatened egotism to violence and aggression: The dark side of high self-esteem.
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Poisson's ratio and modern materials
2011 Standout
Melting of iron at the physical conditions of the Earth's core
2004 Nature
Stability of the body-centred-cubic phase of iron in the Earth's inner core
2003 Nature
First-principles equation-of-state table of beryllium based on density-functional theory calculations
2017
First-principles equation-of-state table of silicon and its effects on high-energy-density plasma simulations
2017
Generalized Neural-Network Representation of High-Dimensional Potential-Energy Surfaces
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Ammonia as a case study for the spontaneous ionization of a simple hydrogen-bonded compound
2014 Standout
22q11.2 deletion syndrome
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New and Old Concepts in Thermoelectric Materials
2009 Standout
New Transformations ofCO 2 at High Pressures and Temperatures
2001
Interpersonal Control and Courtship Aggression
1990
Gender Identity, Self-Esteem, and Physical and Sexual Abuse in Dating Relationships
1988
Rotational Reorganization of Doped Cholesteric Liquid Crystalline Films
2006 StandoutNobel
Melting temperature of ice Ih calculated from coexisting solid-liquid phases
2005
Inelastic x-ray scattering at ultrahigh pressures
2001 StandoutNobel
Raman Spectroscopy of Iron to 152 Gigapascals: Implications for Earth's Inner Core
2000 Science
The maleness of violence in dating relationships: an appraisal of stereotypes
1991
Courtship Violence and the Interactive Status of the Relationship
1986
First-principles calculations for point defects in solids
2014 Standout
Dynamic Chiral Selection and Amplification Using Photoresponsive Organogelators
2005 StandoutNobel
MoleculeNet: a benchmark for molecular machine learning
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Modular Construction of A1+xM4-2xM‘7+xSe15 (A = K, Rb; M = Pb, Sn; M‘ = Bi, Sb): A New Class of Solid State Quaternary Thermoelectric Compounds
2001
Computer Simulation of Liquids
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Necessary and sufficient elastic stability conditions in various crystal systems
2014 Standout
Systematic Parametrization of Polarizable Force Fields from Quantum Chemistry Data
2012
Lanthanide-Activated Phosphors Based on 4f-5d Optical Transitions: Theoretical and Experimental Aspects
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Electron-phonon interactions from first principles
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Crystal structure prediction via particle-swarm optimization
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Spinodal Decomposition and Nucleation and Growth as a Means to Bulk Nanostructured Thermoelectrics: Enhanced Performance in Pb1-xSnxTe−PbS
2007
Shape‐ and Size‐Dependent Kinetic Ethylene Sieving from a Ternary Mixture by a Trap‐and‐Flow Channel Crystal
2022 StandoutNobel
A New Thermoelectric Material: CsBi4Te6
2004
Effects of High Pressure on Molecules
2000
Sound Velocities in Iron to 110 Gigapascals
2001 Science
Quartzlike Carbon Dioxide: An Optically Nonlinear Extended Solid at High Pressures and Temperatures
1999 Science
Pressure dependence of the structure of liquid group 14 elements
2004
Ewald summation of electrostatic multipole interactions up to the quadrupolar level
2003
Courtship Violence among African American College Students
1994
Platinum Metal-Free Catalysts for Selective Soft Oxidative Methane → Ethylene Coupling. Scope and Mechanistic Observations
2015
High‐pressure synthesis of crystalline boron in B–H system
2013 StandoutNobel
Bulk nanostructured thermoelectric materials: current research and future prospects
2009 Standout
ElaStic: A tool for calculating second-order elastic constants from first principles
2013
Deep Eutectic Solvents: A Review of Fundamentals and Applications
2020 Standout
Electronic structure of rare-earth sesquioxides and oxysulfides
2005
Transferable interaction model forAl 2 O 3
2006
Interionic potentials from ab initio molecular dynamics: The alkaline earth oxides CaO, SrO, and BaO
2003
The marriage license as a hitting license: A comparison of assaults in dating, cohabiting, and married couples
1989
Electron-phonon coupling and electron heat capacity of metals under conditions of strong electron-phonon nonequilibrium
2008 Standout
High‐pressure properties and phase diagram of boron
2006
Structural, electronic, and magnetic properties ofFe 2 SiO 4 fayalite: Comparison of LDA and GGA results
2003
Maximally localized Wannier functions: Theory and applications
2012 Standout
Light-Controlled Supramolecular Helicity of a Liquid Crystalline Phase Using a Helical Polymer Functionalized with a Single Chiroptical Molecular Switch
2008 StandoutNobel
Epitaxial graphene on ruthenium
2008 Standout
Mantle plumes from top to bottom
2006
Structural Evolution and Phase Homologies for “Design” and Prediction of Solid-State Compounds
2004
Molecules under extreme conditions: Chemical reactions at high pressure
2003
Progress in Ab Initio QM/MM Free-Energy Simulations of Electrostatic Energies in Proteins: Accelerated QM/MM Studies of pKa, Redox Reactions and Solvation Free Energies
2008 StandoutNobel
Pressure-Induced Solid Carbonates from Molecular CO 2 by Computer Simulation
1999 Science
On optical phonons and elasticity in the hcp transition metals Fe, Ru and Re at high pressure
2001
Physics-informed machine learning
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Graphane: A two-dimensional hydrocarbon
2007 Standout
Rationally Designing High-Performance Bulk Thermoelectric Materials
2016 Standout
Phonon dispersion curves in an argon single crystal at high pressure by inelastic x-ray scattering
2001
Mitigating laser-imprint effects in direct-drive inertial confinement fusion implosions with an above-critical-density foam layer
2018 StandoutNobel
Linear response approach to the calculation of the effective interaction parameters in theLDA + U method
2005 Standout
Age, spreading rates, and spreading asymmetry of the world's ocean crust
2008 Standout
Phonons and related crystal properties from density-functional perturbation theory
2001 Standout
Simulation of structural phase transitions by metadynamics
2005
Calculation of free energies fromab initiocalculation
2002
On representing chemical environments
2013 Standout
Density functional perturbation theory with spin-orbit coupling: Phonon band structure of lead
2008
VASPKIT: A user-friendly interface facilitating high-throughput computing and analysis using VASP code
2021 Standout
First-principles study of binary special quasirandom structures for the Al–Cu, Al–Si, Cu–Si, and Mg–Si systems
2009
Bioinspired Surfaces with Special Wettability
2005 Standout
Identity Theory and Social Identity Theory
2000 Standout
Microstructures and properties of high-entropy alloys
2013 Standout
Close Dating Relationships among College Students: Differences by Use of Violence and by Gender
1991
First principles molecular dynamics simulations of pressure-induced structural transformations in silicon clusters
2001
Nanostructuring, Compositional Fluctuations, and Atomic Ordering in the Thermoelectric Materials AgPbmSbTe2+m. The Myth of Solid Solutions
2005
Courtship Violence: Incidence in a National Sample of Higher Education Students
1991
Referential Communication in Children With ADHD: Challenges in the Role of a Listener
2012
Phonon band structure and interatomic force constants for bismuth: Crucial role of spin-orbit interaction
2007
Pressure-Induced Polymerization of Carbon Monoxide: Disproportionation and Synthesis of an Energetic Lactonic Polymer
2006
Combined Covalent-Electrostatic Model of Hydrogen Bonding Improves Structure Prediction with Rosetta
2015 StandoutNobel
Constant-stress Hugoniostat method for following the dynamical evolution of shocked matter
2004
Crystal structure prediction using ab initio evolutionary techniques: Principles and applications
2006 Standout
About Supramolecular Assemblies of π-Conjugated Systems
2005 Standout
Perovskites in catalysis and electrocatalysis
2017 StandoutScience
Lattice Dynamics of Icosahedralα -Boron under Pressure
1997
First-principles simulations of direct coexistence of solid and liquid aluminum
2003
Locking of Helicity and Shape Complementarity in Diarylethene Dimers on Graphite
2007 StandoutNobel
Works of Stéphane Bernard being referenced
Structural and electronic properties of liquid boron from a molecular-dynamics simulation
1995
Phase transition in Ar(H 2 ) 2 : a prediction of metallic hydrogen organized in lamellar structures
1997
Plane-wave pseudopotential study of the light actinides
2002
First-principles calculation of the melting curve and Hugoniot of tin
2002
Physics of Iron at Earth's Core Conditions
2000 Science
Multiphase equation of state and elastic moduli of solid beryllium from first principles
2010
Courtship Violence and Sex-Typing
1985
Phase transitions in cerium by pseudopotential methods
2001
Conversational perspective‐taking and false belief attribution: A longitudinal study
2007
First-principles equations of state and elastic properties of seven metals
2005
Decomposition and Polymerization of Solid Carbon Monoxide under Pressure
1998
Characterisation of coking activity during supercritical hydrocarbon pyrolysis
2008
Dense hydrogen plasma: Comparison between models
1997