{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.5353879 0.9970923 2.660459 ] [ 0.8434423 2.30713 1.528251 ] [ 1.912844 1.041012 0.0827139 ] [ 2.263312 0.2132627 1.656325 ] [ 2.91731 1.870919 1.650254 ] [ 2.184429 2.813613 2.907386 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.353879e-11 9.970923e-11 2.660459e-10 ] [ 8.434423e-11 2.30713e-10 1.528251e-10 ] [ 1.912844e-10 1.041012e-10 8.27139e-12 ] [ 2.263312e-10 2.132627e-11 1.656325e-10 ] [ 2.91731e-10 1.870919e-10 1.650254e-10 ] [ 2.184429e-10 2.813613e-10 2.907386e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -14.2083967 -36.4741383 26.8248053 ] [ -22.4714209 40.0942781 -30.3210201 ] [ -25.7659086 -2.7869109 -58.3922864 ] [ -3.0920599 -45.1464791 29.8925645 ] [ 82.1158873 13.5317279 -9.1743605 ] [ -16.5781013 30.7815223 41.1702972 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.276436101179187e-08 -5.843801164808586e-08 4.297807590917194e-08 ] [ -3.60031852021365e-08 6.423811499967345e-08 -4.857962952302688e-08 ] [ -4.128153637258966e-08 -4.465123488232688e-09 -9.355475610513781e-08 ] [ -4.954026081893187e-09 -7.233263332545584e-08 4.789316797765604e-08 ] [ 1.315641548283076e-07 2.168021808040708e-08 -1.4698945903891e-08 ] [ -2.656104632011409e-08 4.931743538169385e-08 6.596208764522771e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 38.990663 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 6.246992868809159e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.3291631 0.3564272 2.9191739 ] [ 0.3224117 2.4617425 1.5287177 ] [ 1.4113938 1.2728317 -0.4119973 ] [ 2.3689479 -0.0705805 1.4969548 ] [ 3.9155493 1.6175277 2.4637889 ] [ 2.3092594 3.6050803 2.488751 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.291631e-11 3.564272e-11 2.9191739e-10 ] [ 3.224117000000001e-11 2.461742500000001e-10 1.5287177e-10 ] [ 1.4113938e-10 1.2728317e-10 -4.119973e-11 ] [ 2.3689479e-10 -7.058050000000001e-12 1.4969548e-10 ] [ 3.9155493e-10 1.6175277e-10 2.4637889e-10 ] [ 2.3092594e-10 3.6050803e-10 2.488751e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6.1e-06 8e-06 -5.2e-06 ] [ -1.87e-05 -2.07e-05 -1.9e-06 ] [ -2e-06 -6e-07 7.8e-06 ] [ -8.9e-06 -2.3e-06 -1.68e-05 ] [ 1.4e-06 6.5e-06 1.8e-05 ] [ 2.21e-05 9.2e-06 -1.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.77327738688e-15 1.28174129664e-14 -8.33131842816e-15 ] [ -2.996070280896e-14 -3.316505605055999e-14 -3.04413557952e-15 ] [ -3.2043532416e-15 -9.6130597248e-16 1.249697764224e-14 ] [ -1.425937192512e-14 -3.68500622784e-15 -2.691656722944e-14 ] [ 2.24304726912e-15 1.04141480352e-14 2.88391791744e-14 ] [ 3.540810331968e-14 1.474002491136e-14 -2.72370025536e-15 ] ] } "relaxed-potential-energy" { "source-value" -17.273917 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.767586596703968e-18 } }