{ "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" [ [ 2.924097 1.394529 2.047948 ] [ 0.8517503 3.0229 2.150903 ] [ 3.084941 2.892354 0.5199401 ] [ 2.119748 2.11188 4.047438 ] [ 4.365389 1.647318 4.564937 ] [ 3.247696 3.944508 2.731386 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.924097e-10 1.394529e-10 2.047948e-10 ] [ 8.517503e-11 3.0229e-10 2.150903e-10 ] [ 3.084941000000001e-10 2.892354e-10 5.199401e-11 ] [ 2.119748e-10 2.11188e-10 4.047438e-10 ] [ 4.365389e-10 1.647318e-10 4.564937e-10 ] [ 3.247696e-10 3.944508e-10 2.731386e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.9827233 -1.8025843 4.2771342 ] [ 4.0503674 -0.2222536 -0.6950216 ] [ -1.6892518 2.8595356 -0.0920882 ] [ -0.1324057 1.2997991 -0.4415296 ] [ -1.5982479 0.2401331 -2.8505151 ] [ -1.6131854 -2.3746299 -0.1979797 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.574496308947372e-09 -2.888058446275246e-09 6.852724475722282e-09 ] [ 6.489404007395331e-09 -3.560895247423824e-10 -1.113547367645294e-09 ] [ -2.706479762902441e-09 4.58148112241117e-09 -1.475415623071188e-10 ] [ -2.121373187484138e-10 2.082507746914229e-09 -7.074084083393664e-10 ] [ -2.560675440719568e-09 3.847356418699853e-10 -4.567028688084173e-09 ] [ -2.584607954189944e-09 -3.804576540177756e-09 -3.171984493463298e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -21.11282 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.382646688184788e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.5202001 0.9079353 2.2329429 ] [ 1.2839536 2.9139535 2.0178892 ] [ 3.5030495 2.7988791 1.2048439 ] [ 2.0281572 2.205618 4.1493414 ] [ 4.2472508 2.0905417 3.3362962 ] [ 3.0110101 4.0965614 3.1212384 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5202001e-10 9.079353e-11 2.2329429e-10 ] [ 1.2839536e-10 2.9139535e-10 2.0178892e-10 ] [ 3.5030495e-10 2.7988791e-10 1.2048439e-10 ] [ 2.0281572e-10 2.205618e-10 4.1493414e-10 ] [ 4.2472508e-10 2.0905417e-10 3.3362962e-10 ] [ 3.0110101e-10 4.0965614e-10 3.1212384e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.04e-05 -1.84e-05 1.38e-05 ] [ 3.49e-05 -3.8e-06 9.2e-06 ] [ -3.7e-06 4.9e-06 -8.5e-06 ] [ 3.2e-06 -2.7e-06 -2.87e-05 ] [ 1.34e-05 5.5e-06 4e-07 ] [ -1.74e-05 1.46e-05 1.38e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.870616967359999e-14 -2.94800500656e-14 2.21100375492e-14 ] [ 5.59159645266e-14 -6.088271209199999e-15 1.47400250328e-14 ] [ -5.9280535458e-15 7.850665506599998e-15 -1.3618501389e-14 ] [ 5.1269652288e-15 -4.3258769118e-15 -4.598246939579999e-14 ] [ 2.14691668956e-14 8.811971486999999e-15 6.408706536e-16 ] [ -2.78778734316e-14 2.33917788564e-14 2.21100375492e-14 ] ] } "relaxed-potential-energy" { "source-value" -26.519951 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.248964582702493e-18 } }