Journal of Computer-Aided Materials Design

Title Publication Date Language Citations
An overview of spatial microscopic and accelerated kinetic Monte Carlo methods2007/02/28English310
Core structure and Peierls potential of screw dislocations in α-Fe from first principles: cluster versus dipole approaches2007/12/01English122
Calculations of theoretical strength: State of the art and history2004/01/01English98
Microstructure design of a two phase composite using two-point correlation functions2004/01/01English68
Phase-field model during static recrystallization based on crystal-plasticity theory2007/12/01English63
The Dislocation Bias2007/08/04English61
Computer-aided design of transformation toughened blast resistant naval hull steels: Part I2007/01/25English53
Born–Oppenheimer Interatomic Forces from Simple, Local Kinetic Energy Density Functionals2006/07/25English48
Synthesis of shape and topology of multi-material structures with a phase-field method2004/01/01English46
Prototype evaluation of transformation toughened blast resistant naval hull steels: Part II2007/01/25English41
An Approach for Robust Design of Reactive Power Metal Mixtures Based on Non-deterministic Micro-scale Shock Simulation2005/01/01English40
On the formation of cementitious C–S–H nanoparticles2007/01/23English39
Collision cascades in pure δ-plutonium2007/10/02English36
Magnetic origin of nano-clustering and point defect interaction in Fe–Cr alloys: an ab-initio study2007/12/01English36
Differential formation of allophane and imogolite: experimental and molecular orbital study2007/01/23English32
A multilattice quasicontinuum for phase transforming materials: Cascading Cauchy Born kinematics2007/12/01English31
An integrated framework for multi-scale materials simulation and design2004/01/01English31
Molecular dynamics modeling of cavity strengthening in irradiated iron2007/12/01English29
Void coalescence processes quantified through atomistic and multiscale simulation2007/07/18English29
Multifunctional design of prismatic cellular materials2004/01/01English28
Interatomic potentials for materials with interacting electrons2007/12/01English26
Software Integration in Multi-scale Simulations: the PUPIL System2006/07/25English25
Mechanism of heat transport in nanofluids2007/02/14English23
Atomistic simulations of Ga atom ordering in Pu 5 at. % Ga alloys2007/07/11English20
Cascade damage evolution: rate theory versus kinetic Monte Carlo simulations2007/12/01English18
Static and dynamic properties of the water/amorphous silica interface: a model for the undissociated surface2007/01/23English17
Engineering design of a cardiac myocyte2007/02/15English17
On the reconstruction of polycrystalline microstructures from two-point correlation statistics2004/01/01English17
Multiscale bifurcation and stability of multilattices2007/12/01English16
Dislocation pair correlations from dislocation dynamics simulations2007/12/01English15