Microscopic Rate Constants of Crystal Growth from Molecular Dynamic Simulations Combined with Metadynamics

Table 2

Rate constants for temperature-induced crystallization of Δ𝑇=5 K.

	k cryst	k melt
	𝑇=82 K (mol^−1 s^−1)	𝑇=77 K (mol^−1 s^−1)
Full	9.61 · 10^32	5.73 · 10^32
1 Vacancy	1.21 · 10^33	7.33 · 10^32
2 Vac—orto	1.99 · 10^33	1.25 · 10^33
2 Vac—meta	1.99 · 10^33	1.25 · 10^33
2 Vac—para	1.99 · 10^33	1.25 · 10^33
3 Vac—side by side	2.56 · 10^33	1.63 · 10^33
4 Vac—side by side	3.11 · 10^33	2.00 · 10^33
5 Vacancies	4.86 · 10^33	3.22 · 10^33
6 Vacancies	8.20 · 10^33	5.63 · 10^33
Corner minus	2.42 · 10^33	1.53 · 10^33
Line	6.18 · 10^33	4.16 · 10^33
Front	8.23 · 10^33	5.65 · 10^33
Corner plus	5.37 · 10^34	4.17 · 10^34
Top	5.32 · 10^34	4.12 · 10^34