360 Lattice="11.63622137904167 0.0 0.0 0.0 11.63622137904167 0.0 0.0 0.0 77.57480919361113" Properties=species:S:1:pos:R:3:forces:R:3 energy=-1391.156353934142 stress="0.00185817363101337 2.6156286633990517e-11 1.4472653682956925e-06 2.6156286633990517e-11 0.0018581736291040077 1.4581244607211766e-06 1.4472653682956925e-06 1.4581244607211766e-06 -2.7527089939683225e-10" pbc="T T F" Pd -0.00097093 0.00624047 19.45061761 0.00000433 0.00000384 -0.00000014 Pd 1.93840143 0.00624235 21.33460246 0.00000490 0.00000466 -0.00000009 Pd -0.00096881 1.94561262 21.33460233 0.00000493 0.00000409 0.00000002 Pd 1.93839927 1.94561070 19.45061762 0.00000443 0.00000375 0.00000011 Pd -0.00096370 0.00624685 23.27770619 0.00000463 0.00000449 0.00000001 Pd 1.93841424 0.00625377 25.21686322 0.00000483 0.00000481 0.00000004 Pd -0.00095599 1.94562401 25.21686322 0.00000461 0.00000477 0.00000005 Pd 1.93840655 1.94561710 23.27770623 0.00000477 0.00000431 -0.00000030 Pd -0.00094559 0.00626343 27.15624522 0.00000466 0.00000531 -0.00000004 Pd 1.93843770 0.00627603 29.09561487 0.00000458 0.00000539 0.00000011 Pd -0.00093252 1.94564628 29.09561491 0.00000443 0.00000511 0.00000006 Pd 1.93842463 1.94563367 27.15624520 0.00000487 0.00000513 0.00000005 Pd -0.00091694 0.00629157 31.03498525 0.00000390 0.00000494 0.00000003 Pd 1.93847108 0.00630983 32.97435557 0.00000304 0.00000401 -0.00000001 Pd -0.00089914 1.94568007 32.97435558 0.00000308 0.00000380 -0.00000003 Pd 1.93845328 1.94566182 31.03498524 0.00000395 0.00000469 0.00000001 Pd -0.00087963 0.00633028 34.91372589 0.00000207 0.00000266 0.00000009 Pd 1.93851125 0.00635218 36.85309625 0.00000047 0.00000101 -0.00000018 Pd -0.00085901 1.94572242 36.85309623 0.00000088 0.00000089 -0.00000013 Pd 1.93849061 1.94570051 34.91372590 0.00000187 0.00000248 0.00000010 Pd -0.00083800 0.00637462 38.79246654 -0.00000043 -0.00000080 0.00000016 Pd 1.93855288 0.00639659 40.73183689 -0.00000232 -0.00000253 -0.00000021 Pd -0.00081739 1.94576682 40.73183688 -0.00000166 -0.00000245 -0.00000024 Pd 1.93853227 1.94574485 38.79246655 -0.00000100 -0.00000080 0.00000014 Pd -0.00079790 0.00641716 42.67120716 -0.00000271 -0.00000395 0.00000018 Pd 1.93859013 0.00643556 44.61057746 -0.00000431 -0.00000491 -0.00000017 Pd -0.00078015 1.94580579 44.61057748 -0.00000358 -0.00000472 -0.00000015 Pd 1.93857238 1.94578740 42.67120716 -0.00000344 -0.00000382 0.00000018 Pd -0.00076460 0.00645125 46.54994780 -0.00000419 -0.00000539 0.00000011 Pd 1.93861868 0.00646399 48.48931745 -0.00000501 -0.00000541 0.00000003 Pd -0.00075158 1.94583418 48.48931749 -0.00000451 -0.00000517 -0.00000004 Pd 1.93860567 1.94582147 46.54994776 -0.00000482 -0.00000515 0.00000015 Pd -0.00074122 0.00647375 50.42869951 -0.00000463 -0.00000505 -0.00000003 Pd 1.93863667 0.00648070 52.36785664 -0.00000486 -0.00000459 -0.00000005 Pd -0.00073357 1.94585084 52.36785658 -0.00000460 -0.00000435 0.00000008 Pd 1.93862903 1.94584391 50.42869951 -0.00000501 -0.00000487 -0.00000004 Pd -0.00072853 0.00648515 54.31096046 -0.00000442 -0.00000432 -0.00000024 Pd 1.93864384 0.00648698 56.19494531 -0.00000444 -0.00000379 0.00000002 Pd -0.00072640 1.94585727 56.19494521 -0.00000437 -0.00000378 0.00000009 Pd 1.93864170 1.94585532 54.31096057 -0.00000450 -0.00000391 -0.00000037 Pd -0.00097094 3.88498094 19.45061752 0.00000452 0.00000382 0.00000005 Pd 1.93840148 3.88498285 21.33460237 0.00000417 0.00000397 -0.00000001 Pd -0.00096880 5.82435307 21.33460230 0.00000484 0.00000399 0.00000006 Pd 1.93839927 5.82435119 19.45061760 0.00000441 0.00000388 0.00000005 Pd -0.00096370 3.88498731 23.27770615 0.00000470 0.00000449 -0.00000005 Pd 1.93841423 3.88499421 25.21686322 0.00000502 0.00000500 0.00000005 Pd -0.00095599 5.82436443 25.21686322 0.00000463 0.00000484 0.00000005 Pd 1.93840655 5.82435751 23.27770620 0.00000477 0.00000446 -0.00000020 Pd -0.00094559 3.88500389 27.15624524 0.00000465 0.00000531 -0.00000004 Pd 1.93843770 3.88501649 29.09561489 0.00000453 0.00000532 0.00000007 Pd -0.00093252 5.82438674 29.09561492 0.00000442 0.00000510 0.00000004 Pd 1.93842463 5.82437412 27.15624522 0.00000485 0.00000511 0.00000001 Pd -0.00091693 3.88503204 31.03498527 0.00000389 0.00000492 -0.00000000 Pd 1.93847108 3.88505028 32.97435557 0.00000306 0.00000404 -0.00000002 Pd -0.00089915 5.82442054 32.97435558 0.00000310 0.00000379 -0.00000002 Pd 1.93845328 5.82440229 31.03498525 0.00000397 0.00000467 0.00000002 Pd -0.00087963 3.88507073 34.91372588 0.00000205 0.00000270 0.00000010 Pd 1.93851125 3.88509264 36.85309623 0.00000046 0.00000099 -0.00000014 Pd -0.00085901 5.82446287 36.85309621 0.00000086 0.00000090 -0.00000014 Pd 1.93849061 5.82444098 34.91372589 0.00000184 0.00000249 0.00000010 Pd -0.00083801 3.88511508 38.79246652 -0.00000039 -0.00000084 0.00000018 Pd 1.93855288 3.88513706 40.73183688 -0.00000232 -0.00000254 -0.00000023 Pd -0.00081740 5.82450728 40.73183686 -0.00000164 -0.00000245 -0.00000018 Pd 1.93853226 5.82448530 38.79246653 -0.00000096 -0.00000082 0.00000017 Pd -0.00079790 3.88515765 42.67120717 -0.00000274 -0.00000394 0.00000016 Pd 1.93859013 3.88517605 44.61057748 -0.00000430 -0.00000494 -0.00000016 Pd -0.00078015 5.82454625 44.61057753 -0.00000358 -0.00000472 -0.00000024 Pd 1.93857238 5.82452785 42.67120716 -0.00000347 -0.00000380 0.00000017 Pd -0.00076461 3.88519172 46.54994783 -0.00000417 -0.00000543 0.00000008 Pd 1.93861868 3.88520441 48.48931749 -0.00000502 -0.00000537 -0.00000004 Pd -0.00075158 5.82457464 48.48931755 -0.00000451 -0.00000515 -0.00000005 Pd 1.93860567 5.82456193 46.54994784 -0.00000479 -0.00000516 0.00000007 Pd -0.00074123 3.88521411 50.42869951 -0.00000459 -0.00000495 -0.00000003 Pd 1.93863667 3.88522105 52.36785658 -0.00000480 -0.00000450 0.00000010 Pd -0.00073357 5.82459131 52.36785647 -0.00000459 -0.00000442 0.00000004 Pd 1.93862903 5.82458437 50.42869951 -0.00000507 -0.00000486 -0.00000003 Pd -0.00072852 3.88522556 54.31096035 -0.00000464 -0.00000422 -0.00000014 Pd 1.93864383 3.88522754 56.19494521 -0.00000433 -0.00000392 0.00000007 Pd -0.00072640 5.82459774 56.19494499 -0.00000436 -0.00000386 0.00000045 Pd 1.93864169 5.82459578 54.31096034 -0.00000432 -0.00000392 -0.00000011 Pd -0.00097093 7.76372143 19.45061757 0.00000432 0.00000382 -0.00000001 Pd 1.93840144 7.76372332 21.33460243 0.00000478 0.00000358 -0.00000006 Pd -0.00096873 9.70309354 21.33460239 0.00000372 0.00000389 -0.00000003 Pd 1.93839926 9.70309165 19.45061771 0.00000453 0.00000378 -0.00000051 Pd -0.00096369 7.76372773 23.27770618 0.00000460 0.00000454 -0.00000008 Pd 1.93841424 7.76373464 25.21686322 0.00000486 0.00000513 0.00000007 Pd -0.00095601 9.70310490 25.21686322 0.00000492 0.00000486 0.00000006 Pd 1.93840654 9.70309798 23.27770622 0.00000483 0.00000441 0.00000023 Pd -0.00094559 7.76374433 27.15624523 0.00000469 0.00000533 -0.00000003 Pd 1.93843770 7.76375696 29.09561488 0.00000457 0.00000530 0.00000008 Pd -0.00093252 9.70312720 29.09561490 0.00000436 0.00000510 0.00000007 Pd 1.93842463 9.70311458 27.15624520 0.00000485 0.00000511 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54.31096046 -0.00000498 -0.00000417 -0.00000021 Pd 3.87776945 0.00624046 19.45061766 0.00000448 0.00000395 0.00000005 Pd 5.81714197 0.00624239 21.33460237 0.00000424 0.00000408 -0.00000002 Pd 3.87777173 1.94561267 21.33460241 0.00000420 0.00000336 -0.00000006 Pd 5.81713965 1.94561069 19.45061756 0.00000460 0.00000381 -0.00000003 Pd 3.87777684 0.00624685 23.27770625 0.00000456 0.00000454 -0.00000030 Pd 5.81715476 0.00625376 25.21686322 0.00000492 0.00000497 0.00000005 Pd 3.87778452 1.94562400 25.21686322 0.00000473 0.00000496 0.00000006 Pd 5.81714708 1.94561710 23.27770616 0.00000476 0.00000435 0.00000000 Pd 3.87779490 0.00626343 27.15624519 0.00000464 0.00000530 0.00000005 Pd 5.81717816 0.00627603 29.09561489 0.00000454 0.00000533 0.00000008 Pd 3.87780794 1.94564628 29.09561488 0.00000438 0.00000507 0.00000007 Pd 5.81716513 1.94563368 27.15624523 0.00000480 0.00000511 -0.00000005 Pd 3.87782350 0.00629157 31.03498523 0.00000392 0.00000492 0.00000003 Pd 5.81721151 0.00630983 32.97435557 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-0.00000349 -0.00000379 0.00000019 Pd 3.87797585 0.00645125 46.54994775 -0.00000415 -0.00000538 0.00000017 Pd 5.81735910 0.00646399 48.48931747 -0.00000498 -0.00000543 -0.00000006 Pd 3.87798885 1.94583418 48.48931745 -0.00000449 -0.00000516 -0.00000001 Pd 5.81734613 1.94582147 46.54994777 -0.00000483 -0.00000519 0.00000013 Pd 3.87799919 0.00647375 50.42869951 -0.00000464 -0.00000516 -0.00000004 Pd 5.81737703 0.00648070 52.36785662 -0.00000472 -0.00000457 0.00000019 Pd 3.87800683 1.94585085 52.36785666 -0.00000452 -0.00000442 0.00000008 Pd 5.81736939 1.94584390 50.42869951 -0.00000486 -0.00000475 -0.00000003 Pd 3.87801189 0.00648512 54.31096062 -0.00000418 -0.00000383 -0.00000038 Pd 5.81738440 0.00648698 56.19494530 -0.00000450 -0.00000376 -0.00000021 Pd 3.87801412 1.94585728 56.19494536 -0.00000440 -0.00000389 -0.00000017 Pd 5.81738213 1.94585535 54.31096055 -0.00000471 -0.00000435 -0.00000032 Pd 3.87776946 3.88498094 19.45061762 0.00000442 0.00000383 -0.00000045 Pd 5.81714189 3.88498284 21.33460229 0.00000536 0.00000416 0.00000006 Pd 3.87777172 5.82435303 21.33460237 0.00000440 0.00000461 -0.00000001 Pd 5.81713965 5.82435119 19.45061752 0.00000459 0.00000378 0.00000008 Pd 3.87777684 3.88498730 23.27770616 0.00000453 0.00000451 0.00000033 Pd 5.81715478 3.88499422 25.21686322 0.00000463 0.00000494 0.00000006 Pd 3.87778453 5.82436445 25.21686322 0.00000466 0.00000468 0.00000004 Pd 5.81714708 5.82435751 23.27770615 0.00000473 0.00000442 -0.00000009 Pd 3.87779490 3.88500389 27.15624523 0.00000464 0.00000530 -0.00000012 Pd 5.81717815 3.88501649 29.09561492 0.00000462 0.00000535 0.00000004 Pd 3.87780794 5.82438674 29.09561489 0.00000441 0.00000514 0.00000009 Pd 5.81716512 5.82437412 27.15624524 0.00000483 0.00000512 -0.00000002 Pd 3.87782350 3.88503203 31.03498525 0.00000391 0.00000495 0.00000005 Pd 5.81721151 3.88505028 32.97435558 0.00000306 0.00000403 -0.00000002 Pd 3.87784129 5.82442054 32.97435557 0.00000313 0.00000378 -0.00000003 Pd 5.81719372 5.82440229 31.03498527 0.00000398 0.00000467 0.00000000 Pd 3.87786081 3.88507073 34.91372589 0.00000209 0.00000266 0.00000008 Pd 5.81725170 3.88509263 36.85309622 0.00000049 0.00000099 -0.00000013 Pd 3.87788145 5.82446287 36.85309623 0.00000086 0.00000091 -0.00000014 Pd 5.81723105 5.82444098 34.91372588 0.00000187 0.00000251 0.00000009 Pd 3.87790246 3.88511508 38.79246654 -0.00000042 -0.00000080 0.00000016 Pd 5.81729337 3.88513706 40.73183688 -0.00000236 -0.00000253 -0.00000023 Pd 3.87792308 5.82450728 40.73183687 -0.00000165 -0.00000246 -0.00000022 Pd 5.81727273 5.82448531 38.79246652 -0.00000097 -0.00000084 0.00000019 Pd 3.87794258 3.88515765 42.67120716 -0.00000274 -0.00000398 0.00000016 Pd 5.81733062 3.88517605 44.61057749 -0.00000432 -0.00000496 -0.00000018 Pd 3.87796033 5.82454625 44.61057750 -0.00000361 -0.00000470 -0.00000019 Pd 5.81731287 5.82452785 42.67120717 -0.00000351 -0.00000378 0.00000015 Pd 3.87797586 3.88519172 46.54994779 -0.00000419 -0.00000540 0.00000013 Pd 5.81735910 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