{ "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" [ [ 1.239329 2.983674 3.512225 ] [ 2.999663 5.449943 1.062375 ] [ 1.178907 3.936124 1.554887 ] [ 2.122325 5.087093 3.38156 ] [ 3.136296 3.082629 1.288456 ] [ 5.117946 4.70791 1.219676 ] [ 3.839933 3.58316 3.463374 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.239329e-10 2.983674e-10 3.512225e-10 ] [ 2.999663e-10 5.449943e-10 1.062375e-10 ] [ 1.178907e-10 3.936124e-10 1.554887e-10 ] [ 2.122325e-10 5.087093000000001e-10 3.38156e-10 ] [ 3.136296e-10 3.082629e-10 1.288456e-10 ] [ 5.117946e-10 4.70791e-10 1.219676e-10 ] [ 3.839933e-10 3.58316e-10 3.463374e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 5.5190985 2.0066389 0.2092963 ] [ -2.6373956 -7.8731527 5.8933756 ] [ 1.2017033 6.7654416 0.7887225 ] [ 1.6354032 -5.6572518 -7.2357095 ] [ 5.738948 5.7589918 4.5736191 ] [ -5.7285681 -2.9130274 2.2937084 ] [ -5.7291892 1.9123595 -6.5230124 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.842570584592349e-09 3.214989931967829e-09 3.353296386799431e-10 ] [ -4.225573570120789e-09 -1.26141811879284e-08 9.442228603913173e-09 ] [ 1.925340932398208e-09 1.083943236090775e-08 1.263672749798928e-09 ] [ 2.620204772621507e-09 -9.063916571938717e-09 -1.159288459580046e-08 ] [ 9.194808313586917e-09 9.226922021338911e-09 7.327745594464338e-09 ] [ -9.178177880480678e-09 -4.66718439602981e-09 3.674925973412574e-09 ] [ -9.179172992379856e-09 3.063937681464778e-09 -1.04510179644685e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -38.230554 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.125209981903192e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.8614342 2.93397 3.205298 ] [ 3.0303615 5.2774581 1.5018511 ] [ 1.1386638 4.1426463 1.5020771 ] [ 1.8320632 5.1391429 3.3488134 ] [ 3.0597881 3.0680024 1.358057 ] [ 4.9575523 4.202878 1.3580787 ] [ 3.7545359 4.0664352 3.2083777 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.8614342e-10 2.93397e-10 3.205298e-10 ] [ 3.0303615e-10 5.2774581e-10 1.5018511e-10 ] [ 1.1386638e-10 4.1426463e-10 1.5020771e-10 ] [ 1.8320632e-10 5.1391429e-10 3.3488134e-10 ] [ 3.0597881e-10 3.0680024e-10 1.358057e-10 ] [ 4.9575523e-10 4.202878e-10 1.3580787e-10 ] [ 3.7545359e-10 4.0664352e-10 3.2083777e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 9e-05 -3.58e-05 -4.65e-05 ] [ -0.0001089 1.86e-05 4.66e-05 ] [ 8.25e-05 -7.99e-05 -0.0001069 ] [ 0.0002104 8.68e-05 4.64e-05 ] [ -0.0001907 -8.87e-05 -6.82e-05 ] [ -6.7e-06 2.46e-05 0.0001228 ] [ -7.65e-05 7.44e-05 5.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.44195895872e-13 -5.735792302464001e-14 -7.45012128672e-14 ] [ -1.7447703400512e-13 2.980048514688e-14 7.466143052928e-14 ] [ 1.32179571216e-13 -1.2801391200192e-13 -1.7127268076352e-13 ] [ 3.3709796101632e-13 1.3906893068544e-13 7.434099520512001e-14 ] [ -3.0553508158656e-13 -1.4211306626496e-13 -1.0926844553856e-13 ] [ -1.073458335936e-14 3.941354487168e-14 1.9674728903424e-13 ] [ -1.225665114912e-13 1.1920194058752e-13 9.292624400640001e-15 ] ] } "relaxed-potential-energy" { "source-value" -50.517683 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.093825063958561e-18 } }