{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 3.3347795e-10 4.85338e-11 3.3696327e-10 ] [ 2.8432585e-10 3.1155851e-10 2.8805242e-10 ] [ 1.5171379e-10 1.6549207e-10 4.3147347e-10 ] [ 5.0714322e-10 1.9080593e-10 2.5738428e-10 ] [ 4.6977818e-10 4.1701606e-10 1.4793894e-10 ] [ 4.9178872e-10 3.9712722e-10 4.0507822e-10 ] ] "source-value" [ [ 3.3347795 0.485338 3.3696327 ] [ 2.8432585 3.1155851 2.8805242 ] [ 1.5171379 1.6549207 4.3147347 ] [ 5.0714322 1.9080593 2.5738428 ] [ 4.6977818 4.1701606 1.4793894 ] [ 4.9178872 3.9712722 4.0507822 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -1.47544445009472e-12 3.877267422336e-13 8.08522409920512e-12 ] [ 1.008313834534272e-11 2.12592815813952e-12 1.352140937357952e-11 ] [ -3.2836609843296e-12 -1.482766397251776e-11 -1.496721355618944e-11 ] [ -1.931151546348864e-11 -1.29584045090304e-12 4.13617916425728e-12 ] [ 2.96130304822464e-12 2.94303823474752e-12 6.5320740830016e-12 ] [ 1.10261795043456e-11 1.066681128830016e-11 -1.7307512946192e-11 ] ] "source-value" [ [ -0.0009209 0.000242 0.0050464 ] [ 0.0062934 0.0013269 0.0084394 ] [ -0.0020495 -0.0092547 -0.0093418 ] [ -0.0120533 -0.0008088 0.0025816 ] [ 0.0018483 0.0018369 0.004077 ] [ 0.006882 0.0066577 -0.0108025 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -3.263548060120388e-18 "source-value" -20.369465 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -6.066071079346871e-09 -1.691593024548512e-08 1.122949571752512e-11 ] [ -1.894886743168276e-08 1.2398762773426e-08 3.611592252027675e-09 ] [ -1.082466894421772e-09 1.743103595712582e-09 1.502138474991531e-09 ] [ 1.687790626839666e-08 3.167594343171324e-09 1.093135804561446e-08 ] [ 7.355060462801708e-09 1.221316583258422e-08 -8.833650626473706e-09 ] [ 1.864438834470697e-09 -1.260669629940901e-08 -7.22266764187748e-09 ] ] "source-value" [ [ -3.7861438 -10.5580933 0.0070089 ] [ -11.8269529 7.7386991 2.2541786 ] [ -0.6756227 1.0879597 0.9375611 ] [ 10.5343606 1.9770569 6.8228171 ] [ 4.5906677 7.6228586 -5.5135311 ] [ 1.1636912 -7.868481 -4.5080346 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -2.525713202056585e-18 "source-value" -15.764262 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 3.052782e-10 5.33749e-11 2.863364e-10 ] [ 2.918449e-10 2.894241e-10 2.581593e-10 ] [ 2.15775e-10 1.828991e-10 4.761683e-10 ] [ 4.980199e-10 1.864144e-10 2.667187e-10 ] [ 4.882978e-10 3.954202e-10 1.645371e-10 ] [ 4.390119000000001e-10 4.230009e-10 4.149708000000001e-10 ] ] "source-value" [ [ 3.052782 0.533749 2.863364 ] [ 2.918449 2.894241 2.581593 ] [ 2.15775 1.828991 4.761683 ] [ 4.980199 1.864144 2.667187 ] [ 4.882978 3.954202 1.645371 ] [ 4.390119 4.230009 4.149708 ] ] } "instance-id" 1 }