22 lines
2.0 KiB
Plaintext
22 lines
2.0 KiB
Plaintext
## Time[ps] Etot[eV] Epot[eV] Ekin[eV] <Etot> <Edelta> <Temp[K]>
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5.0000 -122.6787028 -129.9941456 7.3154428 -122.6796180 3.2315 1347.1187
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10.0000 -122.6808395 -131.9791835 9.2983439 -122.6799684 3.2315 1333.2534
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15.0000 -122.6771559 -132.0897832 9.4126274 -122.6803629 3.2315 1380.1259
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20.0000 -122.6794868 -133.2048067 10.5253199 -122.6799477 3.2315 1369.4408
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25.0000 -122.6770863 -132.7027182 10.0256318 -122.6800108 3.2315 1366.9296
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30.0000 -122.6771905 -133.2098215 10.5326310 -122.6798231 3.2315 1365.9479
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35.0000 -122.6876815 -133.2604337 10.5727522 -122.6799756 3.2315 1340.4065
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40.0000 -122.6766067 -133.6887189 11.0121122 -122.6801179 3.2315 1386.6609
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45.0000 -122.6835464 -133.3872138 10.7036675 -122.6800495 3.2315 1364.6557
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50.0000 -122.6803005 -132.4401132 9.7598127 -122.6796965 3.2315 1343.5661
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55.0000 -147.0547140 -147.0634559 0.0087419 -145.0969167 1.7354 26.9904
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60.0000 -147.1352860 -147.1354137 0.0001277 -147.1127612 1.6009 0.1429
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65.0000 -147.1374411 -147.1374477 0.0000066 -147.1369535 1.5993 0.0048
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70.0000 -147.1377068 -147.1377161 0.0000093 -147.1375577 1.5992 0.0007
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75.0000 -147.4796553 -147.4838045 0.0041492 -147.2422352 1.5922 0.9530
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80.0000 -147.8334316 -147.8342396 0.0008079 -147.6949730 1.5620 0.8456
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85.0000 -147.8424591 -147.8424630 0.0000039 -147.8409864 1.5523 0.0159
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90.0000 -147.8425805 -147.8425809 0.0000004 -147.8425428 1.5522 0.0002
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95.0000 -147.8425912 -147.8425913 0.0000000 -147.8425877 1.5522 0.0000
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100.0000 -147.8425923 -147.8425923 0.0000000 -147.8425920 1.5522 0.0000
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