{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.231539e-11 4.398144e-11 9.842089e-11 ] [ 3.052365e-10 2.23226e-11 2.7253682e-10 ] [ 2.4898153e-10 2.8705885e-10 7.87297e-11 ] ] "source-value" [ [ 0.2231539 0.4398144 0.9842089 ] [ 3.052365 0.223226 2.7253682 ] [ 2.4898153 2.8705885 0.787297 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 2.1853689107712e-12 1.42657806316032e-12 3.7074367005312e-13 ] [ -7.993259161171201e-13 6.665054742528e-14 -4.9523279348928e-13 ] [ -1.38604299465408e-12 -1.4932286105856e-12 1.2464934109824e-13 ] ] "source-value" [ [ 0.001364 0.0008904 0.0002314 ] [ -0.0004989 4.16e-05 -0.0003091 ] [ -0.0008651 -0.000932 7.78e-05 ] ] } "species" { "source-value" [ "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" -9.499913050533132e-19 "source-value" -5.9293794 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -4.004277280691021e-07 -1.886912852720274e-07 -1.123579289649375e-07 ] [ 1.432363231341884e-07 1.984265715264396e-07 -3.983913457225167e-08 ] [ 2.57191404774696e-07 -9.735286094194604e-09 1.521970635371892e-07 ] ] "source-value" [ [ -249.9273319 -117.7718379 -70.1283039 ] [ 89.4010818 123.8481257 -24.8656322 ] [ 160.52625 -6.0762877 94.9939361 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 4.934853955795707e-18 "source-value" 30.800936 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 7.176072000000001e-11 7.140121000000001e-11 1.097767e-10 ] [ 2.809034e-10 3.429818e-11 2.513803e-10 ] [ 2.238693e-10 2.476635e-10 8.853041000000001e-11 ] ] "source-value" [ [ 0.7176072 0.7140121 1.097767 ] [ 2.809034 0.3429818 2.513803 ] [ 2.238693 2.476635 0.8853041 ] ] } "instance-id" 1 }