{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.072399 2.177963 4.557602 ] [ 2.377271 3.879759 3.040396 ] [ 5.261436 0.7705425 2.642102 ] [ 4.650297 3.074511 2.607434 ] [ 3.240336 1.703827 1.872622 ] [ 3.483569 0.4560924 3.818111 ] [ 3.60342 3.885532 5.130911 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.072399e-10 2.177963e-10 4.557602e-10 ] [ 2.377271e-10 3.879759e-10 3.040396e-10 ] [ 5.261436e-10 7.705425e-11 2.642102e-10 ] [ 4.650297000000001e-10 3.074511e-10 2.607434e-10 ] [ 3.240336e-10 1.703827e-10 1.872622e-10 ] [ 3.483569e-10 4.560924000000001e-11 3.818111e-10 ] [ 3.60342e-10 3.885532e-10 5.130911000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.5736513 -1.0716278 1.8568053 ] [ -1.6160587 2.8814742 -1.3758019 ] [ 5.5542681 -1.5706849 -1.2633388 ] [ 4.4508544 5.2267393 2.7425156 ] [ -5.860923 -2.5298878 -5.8526404 ] [ -2.2530083 -3.3785552 3.8864787 ] [ 1.2985188 0.442542 0.0059815 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.521267322151527e-09 -1.716937007359338e-09 2.97493004103753e-09 ] [ -2.589211466980441e-09 4.616630596678384e-09 -2.204277639032219e-09 ] [ 8.898918495475237e-09 -2.516514625423586e-09 -2.024091889509527e-09 ] [ 7.131054862264812e-09 8.374159509476557e-09 4.393994376499284e-09 ] [ -9.390233806908998e-09 -4.053327086407146e-09 -9.37696361882956e-09 ] [ -3.609717224728353e-09 -5.413042153522269e-09 6.226825310377177e-09 ] [ 2.080456463029271e-09 7.090304461220736e-10 9.5834194573152e-12 ] ] } "unrelaxed-potential-energy" { "source-value" -19.906255 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.189333636868311e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1366288 2.1594156 4.4621591 ] [ 2.6278395 4.0109278 2.6815879 ] [ 5.1675266 0.8333066 1.9537806 ] [ 4.8039603 2.7745356 3.586386 ] [ 2.7709907 1.5632689 1.9556356 ] [ 3.8511292 0.3223731 3.9887322 ] [ 3.3306529 4.2843993 5.0408966 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1366288e-10 2.1594156e-10 4.4621591e-10 ] [ 2.6278395e-10 4.0109278e-10 2.6815879e-10 ] [ 5.167526600000001e-10 8.333066e-11 1.9537806e-10 ] [ 4.8039603e-10 2.7745356e-10 3.586386e-10 ] [ 2.7709907e-10 1.5632689e-10 1.9556356e-10 ] [ 3.8511292e-10 3.223731e-11 3.9887322e-10 ] [ 3.3306529e-10 4.2843993e-10 5.0408966e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.77e-05 5.94e-05 7.6e-06 ] [ 8.65e-05 -3.13e-05 4.51e-05 ] [ -4.18e-05 6.38e-05 -4.9e-06 ] [ -7.45e-05 -2.4e-05 6.42e-05 ] [ -1.32e-05 -3.18e-05 1.98e-05 ] [ 3.69e-05 -1.48e-05 -3.88e-05 ] [ -3.16e-05 -2.12e-05 -9.3e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.040205860416e-14 9.516929127552e-14 1.217654231808e-14 ] [ 1.385882776992e-13 -5.014812823104e-14 7.225816559807999e-14 ] [ -6.697098274944e-14 1.0221886840704e-13 -7.850665441919999e-15 ] [ -1.193621582496e-13 -3.84522388992e-14 1.0285973905536e-13 ] [ -2.114873139456e-14 -5.094921654144e-14 3.172309709184e-14 ] [ 5.912031730752001e-14 -2.371221398784e-14 -6.216445288704e-14 ] [ -5.062878121728e-14 -3.396614436096001e-14 -1.490024257344e-13 ] ] } "relaxed-potential-energy" { "source-value" -23.579661 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.777878158058956e-18 } }