Skip to main content
U.S. Department of Energy
Office of Scientific and Technical Information

A reactive molecular dynamics study of bi-modal particle size distribution in binder-jetting additive manufacturing using stainless-steel powders

Journal Article · · Physical Chemistry Chemical Physics. PCCP
DOI:https://doi.org/10.1039/d2cp00630h· OSTI ID:1982238
 [1];  [2];  [3];  [1]
  1. Department of Mechanical Engineering, Pennsylvania State University, University Park, 16802, PA, USA
  2. Additive Manufacturing and Design Graduate Program, Pennsylvania State University, University Park, 16802, PA, USA
  3. Department of Mechanical Engineering, Pennsylvania State University, University Park, 16802, PA, USA; Additive Manufacturing and Design Graduate Program, Pennsylvania State University, University Park, 16802, PA, USA

The binder-jetting additive manufacturing using a bimodal particle size distribution is modelled using the ReaxFF reactive molecular dynamics method, which provides an atomistic-level insight into the mechanical and chemical property evolution.

Research Organization:
US Department of Energy (USDOE), Washington, DC (United States). Office of Energy Efficiency and Renewable Energy (EERE)
Sponsoring Organization:
USDOE
OSTI ID:
1982238
Journal Information:
Physical Chemistry Chemical Physics. PCCP, Journal Name: Physical Chemistry Chemical Physics. PCCP Journal Issue: 19 Vol. 24; ISSN 1463-9076; ISSN PPCPFQ
Publisher:
Royal Society of Chemistry
Country of Publication:
United States
Language:
English

References (62)

The melting behavior of aluminum nanoparticles journal October 2007
Impact of Selective Laser Melting Additive Manufacturing on the High Temperature Behavior of AISI 316L Austenitic Stainless Steel journal November 2020
Electronegativity-equalization method for the calculation of atomic charges in molecules journal July 1986
Chromium Vapor Species over Solid Oxide Fuel Cell Interconnect Materials and Their Potential for Degradation Processes journal January 1996
Optimization of Binder Jetting Using Taguchi Method journal January 2017
Hydrogen peroxide synthesis on porous graphitic carbon nitride using water as a hydrogen source journal January 2020
Effect of the particle size and the debinding process on the density of alumina ceramics fabricated by 3D printing based on stereolithography journal November 2016
The mechanical stability of precipitated austenite in 9Ni steel journal December 1985
Isotropic Constitutive Model for Sintering Particle Packings journal August 1990
Oxidation of stainless steel in vacuum and evolution of surface oxide scales during hot-compression bonding journal February 2019
Size-dependent melting temperature of individual nanometer-sized metallic clusters journal November 1990
Lithium oxidation and electrolyte decomposition at Li-metal/liquid electrolyte interfaces journal January 2020
Anisotropy and heterogeneity of microstructure and mechanical properties in metal additive manufacturing: A critical review journal February 2018
Development of a ReaxFF Reactive Force Field for Fe/Cr/O/S and Application to Oxidation of Butane over a Pyrite-Covered Cr 2 O 3 Catalyst journal November 2015
Characterization and corrosion behavior of F6NM stainless steel treated in high temperature water journal March 2018
Molecular dynamics simulations of grain boundary sliding: The effect of stress and boundary misorientation journal March 2007
Diffusion of Oxygen in Liquid Iron journal January 1972
Determination of diffusion coefficient of oxygen in γ-iron from measurements of internal oxidation in Fe-Al alloys journal February 1986
The lattice expansion of iron
  • Basinski, Zbigniew Stanislaw; Hume-Rothery, William; Sutton, A. L.
  • Proceedings of the Royal Society of London. Series A. Mathematical and Physical Sciences, Vol. 229, Issue 1179, p. 459-467 https://doi.org/10.1098/rspa.1955.0102
journal May 1955
XPS and SEM studies of chromium oxide films chemically formed on stainless steel 316 L journal July 2000
A first report on sintering diagrams journal March 1974
The ReaxFF reactive force-field: development, applications and future directions journal March 2016
Effect of Pre-Oxidation at 800 °C on the Pitting Corrosion Resistance of the AISI 316L Stainless Steel journal September 2010
Analysis of the oxidation process of powders and sinters of the austenitic stainless steel journal March 2018
Retained austenite in low carbon, manganese steel after intercritical heat treatment journal July 1994
Molecular dynamics with coupling to an external bath journal October 1984
The solubility of oxygen in gamma iron journal January 1953
Austenite formation in manganese-partitioning dual-phase steel journal December 1986
A second report on sintering diagrams journal February 1981
In situ observations of cracking in constrained sintering journal June 2018
Oxidation of Stainless Steel Powder journal February 2013
Determination of the chemical diffusion of oxygen in liquid iron oxide at 1615 °c journal August 1995
Sintering force behind the viscous sintering of two particles journal May 2016
A ReaxFF molecular dynamics study of molecular-level interactions during binder jetting 3D-printing journal January 2019
VMD: Visual molecular dynamics journal February 1996
Structural changes and anomalous self‐diffusion of oxygen in liquid iron at high pressure journal April 2017
Computer Simulation of Liquids book June 2017
Influence of powder particle size distribution on rheological properties of 316L powder injection moulding feedstocks journal June 2010
Metal Additive Manufacturing: A Review of Mechanical Properties journal July 2016
The Solubility of Oxygen in Liquid Iron Oxide During the Combustion of Iron Rods in High-Pressure Oxygen journal April 1998
Effect of atomization on surface oxide composition in 316L stainless steel powders for additive manufacturing journal June 2020
Molecular dynamics study of melting, diffusion, and sintering of cementite chromia core–shell particles journal November 2021
The composition of precipitated austenite in 5.5ni steel journal November 1981
ReaxFF:  A Reactive Force Field for Hydrocarbons journal October 2001
Role of molybdenum on the AISI 316L oxidation at 900 °C journal November 2008
Binder Jetting Additive Manufacturing: Effect of Particle Size Distribution on Density journal March 2021
Theoretical and Experimental Investigation of the Thermochemistry of CrO 2 (OH) 2 (g) journal March 2007
Infiltration of Nanoparticles into Porous Binder Jet Printed Parts journal January 2016
The solubility of oxygen in liquid iron containing aluminum journal February 1950
Morse Stretch Potential Charge Equilibrium Force Field for Ceramics: Application to the Quartz-Stishovite Phase Transition and to Silica Glass journal February 1999
A comparative study on the oxidation of two-dimensional Ti 3 C 2 MXene structures in different environments journal January 2018
Ultrafine-grained microstructures and mechanical properties of alloy steels journal April 1972
Melting of Isolated Tin Nanoparticles journal August 2000
Carbon partitioning into austenite after martensite transformation journal May 2003
Charge equilibration for molecular dynamics simulations journal April 1991
Binder jet 3D printing—Process parameters, materials, properties, modeling, and challenges journal June 2020
Size-Dependent Melting Properties of Small Tin Particles: Nanocalorimetric Measurements journal July 1996
Interactions of hydrogen with the iron and iron carbide interfaces: a ReaxFF molecular dynamics study journal January 2016
Evaluation of the effect of nickel clusters on the formation of incipient soot particles from polycyclic aromatic hydrocarbons via ReaxFF molecular dynamics simulations journal January 2019
Enhancement of elongation by retained austenite in intercritical annealed 0.4C-1.5Si-0.8Mn steel. journal January 1987
Studies on 6% Nickel Steel for Low Temperature Uses journal January 1971
Melting and crystallization in Ni nanoclusters: The mesoscale regime journal July 2001

Similar Records

Packing density optimization and recyclability of multi-modal SiC powder feedstocks in binder jet additive manufacturing
Journal Article · Tue Jul 29 20:00:00 EDT 2025 · Ceramics International · OSTI ID:2583805

A Review on Binder Jet Additive Manufacturing of 316L Stainless Steel
Journal Article · Sun Sep 08 20:00:00 EDT 2019 · Journal of Manufacturing and Materials Processing · OSTI ID:1647748

Binder jet additive manufacturing of silicon carbide solar reactor
Technical Report · Sun Jun 01 00:00:00 EDT 2025 · OSTI ID:2572190

Related Subjects