International Scholarly Research Notices / 2014 / Article / Tab 3 / Research Article
Study of the Nanomechanics of CNTs under Tension by Molecular Dynamics Simulation Using Different Potentials Table 3 Elastic, elastic-plastic properties of multiwall CNT by the tension test (tension test is carried out by applying velocity of some atoms at both ends of the CNT, 20 m/s).
Potentials
, GPa
, GPa
, GPa
Double-walled 5-5, 10-10 CNT 9.1 Airebo [29 ] 1014.5 112.82160 0.21750 175.50349 0.32870 Tersoff [10 ] 1152.9 112.3452 0.16460 162.50680 0.27450 Rebo [11 ] 970.41 112.63770 0.22090 198.80260 0.33950 Rebo [31 ] 1000.9 112.44860 0.21870 192.85950 0.34840 Inclusion
with Rebo [11 ] 983.05 113.17720 0.22080 168.55659 0.30890 4.51 Airebo [29 ] 1047 113.95940 0.22380 168.98421 0.31490 Tersoff [10 ] 1053.6 114.49510 0.22250 170.08620 0.31500 Rebo [11 ] 1063.8 113.55300 0.21690 177.22290 0.32990 Rebo [31 ] 1061.7 113.04890 0.21790 163.33620 0.30550 Inclusion
with Rebo [11 ] 1045.1 114.15500 0.22350 172.63960 0.31340 Three-walled 5-5, 10-10, 15-15 CNT 9.1 Airebo [29 ] 1071.2 114.03640 0.21340 176.42340 0.30660 Tersoff 1112.1 117.7347 0.1846 180.9215 0.2946 Rebo [11 ] 960.32 113.11430 0.21650 224.30141 0.34430 Rebo [31 ] 1011.3 111.75010 0.20460 212.10780 0.34500 Inclusion
with Rebo [11 ] 1118.5 110.95180 0.19090 174.31090 0.29360 4.51 Airebo [29 ] 757.97 80.74040 0.20330 123.15620 0.31920 Tersoff [10 ] 917.49 84.03300 0.17470 108.58530 0.27420 Rebo [11 ] 755.7 82.83280 0.22410 142.03690 0.32090 Rebo [31 ] 756.59 80.30010 0.20370 117.80770 0.30060 Include
with Rebo [11 ] 759.4 80.85670 0.20450 127.86900 0.30110 Four-walled 5-5, 10-0, 15-15, 20-20 CNT 9.1 Airebo [29 ] 956.18 113.64290 0.22340 162.12520 0.31360 Tersoff [10 ] 1162.3 117.3119 0.1849 166.3823 0.2750 Rebo [11 ] 832.63 111.00820 0.21450 213.49680 0.35470 Rebo [31 ] 877.48 111.14260 0.21370 189.54539 0.34470 Inclusion
with Rebo [11 ] 1053 113.42000 0.21490 171.45770 0.31030 4.51 Airebo [29 ] 1222 136.58340 0.21970 190.49490 0.37090 Tersoff [10 ] 1052.8 116.5393 0.1853 167.8656 0.2843 Rebo [11 ] 1174.4 133.39349 0.20440 244.05009 0.33610 Rebo [31 ] 1150 136.24100 0.22530 225.16690 0.34280 Inclusion
with Rebo [11 ] 1273.8 137.69620 0.22140 213.03430 0.30450
