A MD Simulation and Analysis for Aggregation Behaviors of Nanoscale Zero-Valent Iron Particles in Water via MS

Table 1

Distances of two NZVI particles in initial system and minimization system of systems 1–5.

Simulation system	System 1	System 2	System 3	System 4	System 5
Distance of initial system (nm)	0.7	0.85	0.94	0.111	0.126
Distance of minimization system (nm)	0.78	0.88	0.1	0.125	0.135