Commit 7237728

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corrected force

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level1/breaking-a-carbon-nanotube/unbreakable-bonds

3 files changed

+175

-175

lines changed

`‎level1/breaking-a-carbon-nanotube/unbreakable-bonds/edge_force.dat‎`

Lines changed: 151 additions & 151 deletions

Original file line number	Diff line number	Diff line change
`@@ -1,152 +1,152 @@`
`1`	`1`	`# Time-averaged data for fix at2`
`2`		`-# TimeStep f_mysf1[1] f_mysf2[1]`
`3`		`-100 -5.91434 5.39518`
`4`		`-200 3.20912 -32.74`
`5`		`-300 22.9316 30.0158`
`6`		`-400 -19.3663 -2.30978`
`7`		`-500 -12.9371 22.7585`
`8`		`-600 12.1567 -6.88954`
`9`		`-700 -28.2221 4.63754`
`10`		`-800 7.03157 4.26907`
`11`		`-900 20.5082 -11.8269`
`12`		`-1000 -2.29241 -4.50433`
`13`		`-1100 -0.439827 1.1668`
`14`		`-1200 -18.7629 -5.48124`
`15`		`-1300 19.1304 25.0324`
`16`		`-1400 -25.221 2.13628`
`17`		`-1500 -4.1785 23.9898`
`18`		`-1600 -2.8111 -30.4211`
`19`		`-1700 9.89048 -21.9095`
`20`		`-1800 -4.08634 2.9283`
`21`		`-1900 17.3075 19.7819`
`22`		`-2000 -11.3823 -7.34474`
`23`		`-2100 1.40959 2.78615`
`24`		`-2200 -29.1392 28.2275`
`25`		`-2300 -1.82222 -8.0062`
`26`		`-2400 17.7268 0.343305`
`27`		`-2500 14.9681 4.99282`
`28`		`-2600 -13.9724 -16.9303`
`29`		`-2700 16.1523 8.83726`
`30`		`-2800 -9.95378 -9.86245`
`31`		`-2900 -21.9849 16.7248`
`32`		`-3000 8.57508 47.608`
`33`		`-3100 -17.0008 -41.0412`
`34`		`-3200 4.65273 -14.4357`
`35`		`-3300 -5.03751 11.3902`
`36`		`-3400 5.34324 -0.897554`
`37`		`-3500 19.882 -14.3119`
`38`		`-3600 -16.9809 14.9183`
`39`		`-3700 -21.9667 -3.63674`
`40`		`-3800 0.892693 22.3842`
`41`		`-3900 10.8776 1.05734`
`42`		`-4000 -13.5072 7.71363`
`43`		`-4100 10.9821 -6.65203`
`44`		`-4200 25.8966 -16.1278`
`45`		`-4300 -35.0755 -15.6219`
`46`		`-4400 22.8992 43.8084`
`47`		`-4500 -21.973 3.95503`
`48`		`-4600 7.48992 -22.1838`
`49`		`-4700 -11.375 31.525`
`50`		`-4800 -14.5546 -15.6713`
`51`		`-4900 22.203 -9.93837`
`52`		`-5000 26.1043 0.35876`
`53`		`-5100 -36.646 -4.6794`
`54`		`-5200 2.20647 -12.9668`
`55`		`-5300 -8.71951 36.5644`
`56`		`-5400 -2.41801 -5.35237`
`57`		`-5500 -15.6618 10.8304`
`58`		`-5600 17.7707 5.26039`
`59`		`-5700 -2.57261 -36.6891`
`60`		`-5800 2.2134 20.3767`
`61`		`-5900 19.6448 -2.63054`
`62`		`-6000 -20.0205 21.4689`
`63`		`-6100 24.4947 -16.3616`
`64`		`-6200 -66.0263 36.2234`
`65`		`-6300 6.77746 -4.77782`
`66`		`-6400 36.7944 -8.23671`
`67`		`-6500 -14.5669 -11.485`
`68`		`-6600 16.5147 4.88637`
`69`		`-6700 -29.0367 -5.76826`
`70`		`-6800 10.3785 -7.64944`
`71`		`-6900 -25.8852 46.9019`
`72`		`-7000 3.74285 -13.4806`
`73`		`-7100 -13.1991 3.65984`
`74`		`-7200 8.40036 -4.30973`
`75`		`-7300 6.47564 -12.1488`
`76`		`-7400 28.4798 18.9247`
`77`		`-7500 -16.016 -13.1517`
`78`		`-7600 -32.7101 14.2411`
`79`		`-7700 12.9995 15.6336`
`80`		`-7800 -18.5742 6.0776`
`81`		`-7900 5.27884 7.31798`
`82`		`-8000 12.0599 -6.09973`
`83`		`-8100 -3.25213 -38.4624`
`84`		`-8200 -4.53597 27.8113`
`85`		`-8300 -0.97395 9.39585`
`86`		`-8400 -22.8427 15.9568`
`87`		`-8500 -11.4281 -0.0400833`
`88`		`-8600 -18.8173 -3.24273`
`89`		`-8700 35.1386 0.247248`
`90`		`-8800 24.8453 -26.1106`
`91`		`-8900 -26.5262 30.9164`
`92`		`-9000 -11.8987 -11.0504`
`93`		`-9100 -14.1 30.1701`
`94`		`-9200 2.28045 12.5006`
`95`		`-9300 1.07648 9.36505`
`96`		`-9400 0.945382 -30.4075`
`97`		`-9500 4.8091 3.99838`
`98`		`-9600 -2.25623 -11.1481`
`99`		`-9700 -23.248 28.2004`
`100`		`-9800 0.887606 8.74532`
`101`		`-9900 -36.3933 7.95541`
`102`		`-10000 21.0993 5.04831`
`103`		`-10100 12.5398 -28.7016`
`104`		`-10200 1.12884 12.1827`
`105`		`-10300 -7.24015 -6.77783`
`106`		`-10400 -18.5087 18.4993`
`107`		`-10500 0.958713 36.8046`
`108`		`-10600 -2.55653 -1.86515`
`109`		`-10700 3.64647 -18.2889`
`110`		`-10800 -11.1335 -0.211118`
`111`		`-10900 15.4285 -9.21488`
`112`		`-11000 -3.24224 20.2127`
`113`		`-11100 -28.1043 3.25503`
`114`		`-11200 -21.2935 23.6633`
`115`		`-11300 2.54731 -15.2026`
`116`		`-11400 6.45193 11.5364`
`117`		`-11500 21.5032 -14.842`
`118`		`-11600 -27.0918 -14.6405`
`119`		`-11700 4.49751 41.5415`
`120`		`-11800 -24.6272 8.74628`
`121`		`-11900 11.322 10.9508`
`122`		`-12000 -16.9557 5.35201`
`123`		`-12100 17.188 -27.8207`
`124`		`-12200 7.88892 17.6146`
`125`		`-12300 -17.0383 -17.1022`
`126`		`-12400 -17.6168 41.8783`
`127`		`-12500 -19.6721 -10.2584`
`128`		`-12600 -7.73181 7.46003`
`129`		`-12700 26.7005 -4.47145`
`130`		`-12800 -13.73 -17.9509`
`131`		`-12900 6.27437 26.4216`
`132`		`-13000 -22.7157 13.3868`
`133`		`-13100 -1.09668 23.4501`
`134`		`-13200 -16.0571 5.64568`
`135`		`-13300 2.53367 -23.2888`
`136`		`-13400 32.188 6.98436`
`137`		`-13500 -34.9255 -5.95373`
`138`		`-13600 9.53652 25.5055`
`139`		`-13700 -38.1285 4.85266`
`140`		`-13800 -16.5744 5.97724`
`141`		`-13900 11.9232 4.12321`
`142`		`-14000 17.3582 -24.0106`
`143`		`-14100 -9.99544 17.2592`
`144`		`-14200 4.14717 -9.13524`
`145`		`-14300 -21.3106 51.2331`
`146`		`-14400 -14.8561 3.91252`
`147`		`-14500 -10.1184 6.84796`
`148`		`-14600 37.7078 -20.5189`
`149`		`-14700 -21.9922 17.146`
`150`		`-14800 14.9612 -11.3224`
`151`		`-14900 -48.3651 6.33318`
`152`		`-15000 -3.46181 38.345`
	`2`	`+# TimeStep f_mysf1[3] f_mysf2[3]`
	`3`	`+100 -62.6792 65.454`
	`4`	`+200 -73.5118 40.5037`
	`5`	`+300 -14.1747 59.9959`
	`6`	`+400 -78.4066 74.7844`
	`7`	`+500 -50.0585 51.4659`
	`8`	`+600 -50.2181 51.4017`
	`9`	`+700 -120.635 67.544`
	`10`	`+800 2.97359 31.2505`
	`11`	`+900 -63.8666 66.3678`
	`12`	`+1000 -96.0929 113.694`
	`13`	`+1100 -17.3415 8.24996`
	`14`	`+1200 -59.2533 67.3688`
	`15`	`+1300 -109.131 62.1382`
	`16`	`+1400 -19.7637 50.3381`
	`17`	`+1500 -59.7219 62.6377`
	`18`	`+1600 -61.8386 88.8562`
	`19`	`+1700 -41.0659 39.3125`
	`20`	`+1800 -89.1119 56.3082`
	`21`	`+1900 -76.3477 66.1262`
	`22`	`+2000 -32.6984 17.3058`
	`23`	`+2100 -76.2127 89.6176`
	`24`	`+2200 -40.5599 98.4373`
	`25`	`+2300 -55.3118 24.8991`
	`26`	`+2400 -45.7573 51.4537`
	`27`	`+2500 -118.968 78.6958`
	`28`	`+2600 -16.8916 30.4206`
	`29`	`+2700 -57.8458 69.9492`
	`30`	`+2800 -60.42 91.6411`
	`31`	`+2900 -72.8818 18.6725`
	`32`	`+3000 -46.9187 65.2311`
	`33`	`+3100 -78.2307 60.4753`
	`34`	`+3200 -19.1448 54.0772`
	`35`	`+3300 -61.9773 85.9973`
	`36`	`+3400 -90.0586 74.2945`
	`37`	`+3500 -31.282 0.696685`
	`38`	`+3600 -86.4469 63.0823`
	`39`	`+3700 -86.0602 71.7048`
	`40`	`+3800 -33.7338 57.4728`
	`41`	`+3900 -16.1822 75.8111`
	`42`	`+4000 -70.9935 80.4781`
	`43`	`+4100 -62.8121 49.5136`
	`44`	`+4200 -79.64 37.7579`
	`45`	`+4300 -99.2618 58.7555`
	`46`	`+4400 -17.9898 47.3104`
	`47`	`+4500 -42.9481 79.1386`
	`48`	`+4600 -88.0025 99.8983`
	`49`	`+4700 -14.6805 13.7497`
	`50`	`+4800 -86.1321 50.8173`
	`51`	`+4900 -86.5656 91.8068`
	`52`	`+5000 -29.8809 31.4373`
	`53`	`+5100 -86.3827 106.859`
	`54`	`+5200 -116.761 106.255`
	`55`	`+5300 -75.864 73.0647`
	`56`	`+5400 -204.795 154.417`
	`57`	`+5500 -136.547 190.859`
	`58`	`+5600 -158.915 142.238`
	`59`	`+5700 -214.013 270.347`
	`60`	`+5800 -248.598 224.291`
	`61`	`+5900 -256.71 195.986`
	`62`	`+6000 -283.88 292.883`
	`63`	`+6100 -324.346 339.898`
	`64`	`+6200 -272.842 284.243`
	`65`	`+6300 -347.192 382.344`
	`66`	`+6400 -392.964 385.845`
	`67`	`+6500 -380.934 348.252`
	`68`	`+6600 -434.933 424.235`
	`69`	`+6700 -459.753 449.9`
	`70`	`+6800 -414.838 442.242`
	`71`	`+6900 -491.048 490.766`
	`72`	`+7000 -523.243 538.627`
	`73`	`+7100 -517.357 467.955`
	`74`	`+7200 -542.073 571.992`
	`75`	`+7300 -605.055 600.177`
	`76`	`+7400 -558.413 570.381`
	`77`	`+7500 -609.77 625.149`
	`78`	`+7600 -683.231 669.413`
	`79`	`+7700 -643.247 615.352`
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	`81`	`+7900 -735.414 745.339`
	`82`	`+8000 -683.568 713.613`
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	`85`	`+8300 -783.657 761.57`
	`86`	`+8400 -819.999 811.947`
	`87`	`+8500 -846 890.295`
	`88`	`+8600 -828.111 842.881`
	`89`	`+8700 -872.781 890.527`
	`90`	`+8800 -980.485 916.437`
	`91`	`+8900 -883.632 890.495`
	`92`	`+9000 -973.883 939.475`
	`93`	`+9100 -976.085 1035.1`
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	`105`	`+10300 -1276.3 1291.91`
	`106`	`+10400 -1215.85 1263.84`
	`107`	`+10500 -1282.51 1250.65`
	`108`	`+10600 -1340.77 1357.29`
	`109`	`+10700 -1348.07 1264.48`
	`110`	`+10800 -1305.89 1369.93`
	`111`	`+10900 -1415.51 1391.7`
	`112`	`+11000 -1371.93 1422.35`
	`113`	`+11100 -1394.31 1370.26`
	`114`	`+11200 -1476.15 1482.15`
	`115`	`+11300 -1485.77 1436.74`
	`116`	`+11400 -1440.94 1482.45`
	`117`	`+11500 -1546.53 1540.98`
	`118`	`+11600 -1502.97 1530.57`
	`119`	`+11700 -1535.11 1522.48`
	`120`	`+11800 -1625.03 1598.18`
	`121`	`+11900 -1614.57 1583.75`
	`122`	`+12000 -1562.81 1604.43`
	`123`	`+12100 -1662.97 1692.41`
	`124`	`+12200 -1685.69 1667.35`
	`125`	`+12300 -1634.17 1651.5`
	`126`	`+12400 -1787.11 1718.23`
	`127`	`+12500 -1719.15 1735.87`
	`128`	`+12600 -1713.29 1714.14`
	`129`	`+12700 -1798.17 1845.7`
	`130`	`+12800 -1787.56 1784.95`
	`131`	`+12900 -1803.26 1810.82`
	`132`	`+13000 -1896.87 1837.63`
	`133`	`+13100 -1855 1869.19`
	`134`	`+13200 -1872.42 1856.66`
	`135`	`+13300 -1904.72 1963.41`
	`136`	`+13400 -1941.47 1931.77`
	`137`	`+13500 -1931.62 1927.5`
	`138`	`+13600 -2007.3 1978.02`
	`139`	`+13700 -2022.72 2017.54`
	`140`	`+13800 -1976.68 1988.99`
	`141`	`+13900 -2059.77 2084.07`
	`142`	`+14000 -2078.88 2069.23`
	`143`	`+14100 -2065.2 2055.97`
	`144`	`+14200 -2150.58 2140.45`
	`145`	`+14300 -2127.26 2129.04`
	`146`	`+14400 -2111.4 2130.75`
	`147`	`+14500 -2207.5 2224.65`
	`148`	`+14600 -2220.01 2198.57`
	`149`	`+14700 -2208.5 2185.75`
	`150`	`+14800 -2252.61 2254.21`
	`151`	`+14900 -2284.09 2292.34`
	`152`	`+15000 -2268.76 2285.43`

`‎level1/breaking-a-carbon-nanotube/unbreakable-bonds/input.lammps‎`

Lines changed: 1 addition & 1 deletion

Original file line number	Diff line number	Diff line change
`@@ -76,7 +76,7 @@ velocity carbon_bot set 0 0 0`
`76`	`76`
`77`	`77`	`variable L equal xcm(carbon_top,z)-xcm(carbon_bot,z)`
`78`	`78`	`fix at1 all ave/time 10 10 100 v_L file cnt_length.dat`
`79`		`-fix at2 all ave/time 10 10 100 f_mysf1[1] f_mysf2[1] file edge_force.dat`
	`79`	`+fix at2 all ave/time 10 10 100 f_mysf1[3] f_mysf2[3] file edge_force.dat`
`80`	`80`	`dump mydmp all atom 1000 dump.lammpstrj`
`81`	`81`
`82`	`82`	`fix at3 all ave/time 10 10 100 c_Tmid file temperature_middle_group.dat`

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Commit 7237728

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3 files changed

3 files changed

`‎level1/breaking-a-carbon-nanotube/unbreakable-bonds/edge_force.dat‎`

`‎level1/breaking-a-carbon-nanotube/unbreakable-bonds/input.lammps‎`

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