Research graph
References from Efficient rigorous stress field calculations for machine learning interatomic potentials. Local targets link to admitted publications; unresolved targets remain external evidence.
Influence of stress correlations on dislocation glide in random alloys
10.1103/physrevmaterials.6.033605 · 2022 · External reference
Atomistically informed partial dislocation dynamics of multi-principal element alloys
10.1016/j.jmps.2025.106478 · 2026 · External reference
Atomistic investigation of the T-stress effect on fracture toughness of copper and aluminum single crystals
10.1007/s12206-018-0729-0 · 2018 · External reference
Local yield stress statistics in model amorphous solids
10.1103/physreve.97.033001 · 2018 · External reference
A unified interpretation of stress in molecular systems
10.1007/s10659-010-9249-6 · 2010 · External reference
A simple numerical approach for reconstructing the atomic stresses at grain boundaries from quantum-mechanical calculations
10.1063/1.5085061 · 2019 · External reference
General formulation of pressure and stress tensor for arbitrary many-body interaction potentials under periodic boundary conditions
10.1063/1.3245303 · 2009 · External reference
Fast parallel algorithms for short-range molecular dynamics
10.1006/jcph.1995.1039 · 1995 · External reference
LAMMPS – a flexible simulation tool for particle-based materials modeling at the atomic, meso and continuum scales
10.1016/j.cpc.2021.108171 · 2022 · External reference
Size–dependent fracture toughness of nanoscale structures: crack–tip stress approach in molecular dynamics
10.1061/(asce)nm.2153-5477.0000063 · 2014 · External reference
Local stress field in wafer thinning simulations with phase space averaging
10.32604/cmc.2021.016372 · 2021 · External reference
Strain perturbation method for atomic stress calculation with machine-learning potentials
10.1103/jg6w-fdl8 · 2025 · External reference
Implementation of atomic stress calculations with artificial neural network potentials
10.2320/matertrans.mt-m2023093 · 2023 · External reference
Unresolved reference
2011 · External reference
The non-linear field theories of mechanics
2004 · External reference
Formulas for determining local properties in molecular dynamics simulation: shock waves
10.1063/1.442714 · 1982 · External reference
Continuum properties from molecular simulations
10.1063/1.1483554 · 2002 · External reference
The motivation of continuum concepts and relations from discrete considerations
10.1093/qjmam/36.2.163 · 1982 · External reference
On the physical interpretation of fields in continuum mechanics
10.1016/0020-7225(93)90002-c · 1993 · External reference
Continuum equations of balance via weighted averages of microscopic quantities
10.1098/rspa.1994.0054 · 1994 · External reference
On the microscopic interpretation of stress and couple stress
10.1023/b:elas.0000005552.04968.08 · 2003 · External reference
A critique of atomistic definitions of the stress tensor
10.1007/s10659-007-9121-5 · 2007 · External reference
Material fields in atomistics as pull-backs of spatial distributions
10.1016/j.jmps.2016.01.006 · 2016 · External reference
Noise filtering in atomistic stress calculations for crystalline materials
10.1016/j.jmps.2020.104083 · 2020 · External reference
MDStressLab++
External reference
Energy density in density functional theory: application to crystalline defects and surfaces
10.1103/physrevb.83.115113 · 2011 · External reference
Microelasticity model of random alloys. Part I: mean square displacements and stresses
10.1016/j.jmps.2021.104479 · 2021 · External reference
Microelasticity model of random alloys. Part II: displacement and stress correlations
10.1016/j.jmps.2021.104480 · 2021 · External reference
Theory for the portable model interface
2025 · External reference
Grain-boundary segregation in Al–10% Mg alloys at hot working temperatures
10.1016/s1359-6454(98)00038-x · 1998 · External reference
The non-uniqueness of the atomistic stress tensor and its relationship to the generalized Beltrami representation
10.1016/j.jmps.2016.03.016 · 2016 · External reference
Second-order rigidity and prestress stability for tensegrity frameworks
10.1137/s0895480192229236 · 1996 · External reference
Unresolved reference
2010 · External reference
Nearsightedness of electronic matter
10.1073/pnas.0505436102 · 2005 · External reference
Unresolved reference
1963 · External reference
Computer simulation of local order in condensed phases of silicon
10.1103/physrevb.31.5262 · 1985 · External reference
Unresolved reference
1985 · External reference
Unresolved reference
2021 · External reference
Empirical interatomic potential for silicon with improved elastic properties
10.1103/physrevb.38.9902 · 1988 · External reference
Unresolved reference
1988 · External reference
Unresolved reference
2021 · External reference
Energy landscape of silicon tetra-interstitials using an optimized classical potential
10.1002/pssb.201147137 · 2011 · External reference
Unresolved reference
2011 · External reference
Unresolved reference
2023 · External reference
Unresolved reference
2020 · External reference
Unresolved reference
2026 · External reference
Unresolved reference
2026 · External reference
Unresolved reference
2026 · External reference
The potential of atomistic simulations and the knowledge base of interatomic models
10.1007/s11837-011-0102-6 · 2011 · External reference
Unresolved reference
External reference
Unresolved reference
2019 · External reference
Performance and cost assessment of machine learning interatomic potentials
10.1021/acs.jpca.9b08723 · 2020 · External reference
Unresolved reference
2026 · External reference
Generalized neural-network representation of high-dimensional potential-energy surfaces
10.1103/physrevlett.98.146401 · 2007 · External reference
KLIFF: a framework to develop analytic and machine learning interatomic potentials
10.1016/j.cpc.2021.108218 · 2022 · External reference
Si PRX GAP dataset
2023 · External reference
ColabFit exchange: open-access datasets for data-driven interatomic potentials
10.1063/5.0163882 · 2023 · External reference
Unresolved reference
External reference
