{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.4776215e-10 1.4918499e-10 1.582998e-10 ] [ 1.4778635e-10 1.6264731e-10 3.7566383e-10 ] [ 4.664688700000001e-10 1.4200213e-10 2.6766706e-10 ] [ 3.5569638e-10 2.4911617e-10 4.5763114e-10 ] [ 5.3734534e-10 3.5097231e-10 1.7246608e-10 ] [ 2.8622768e-10 3.8055103e-10 1.0899142e-10 ] [ 3.6984644e-10 4.580318100000001e-10 3.4098577e-10 ] ] "source-value" [ [ 2.4776215 1.4918499 1.582998 ] [ 1.4778635 1.6264731 3.7566383 ] [ 4.6646887 1.4200213 2.6766706 ] [ 3.5569638 2.4911617 4.5763114 ] [ 5.3734534 3.5097231 1.7246608 ] [ 2.8622768 3.8055103 1.0899142 ] [ 3.6984644 4.5803181 3.4098577 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 2.43867303451968e-12 5.2182892539456e-13 -1.9081923553728e-13 ] [ -2.3984584013376e-13 -2.29944388617216e-12 5.8896012580608e-13 ] [ -4.17254857354944e-12 -1.21509074921472e-12 -6.536880612864e-14 ] [ -1.92261194496e-15 4.36064410883136e-12 -3.172309709184e-14 ] [ 3.66433814943168e-12 3.1098248209728e-13 -3.25177766957568e-12 ] [ -6.2693171171904e-13 3.2219771844288e-13 -4.52614895376e-13 ] [ -1.06192266426624e-12 -2.00127881704128e-12 3.40350379556544e-12 ] ] "source-value" [ [ 0.0015221 0.0003257 -0.0001191 ] [ -0.0001497 -0.0014352 0.0003676 ] [ -0.0026043 -0.0007584 -4.08e-05 ] [ -1.2e-06 0.0027217 -1.98e-05 ] [ 0.0022871 0.0001941 -0.0020296 ] [ -0.0003913 0.0002011 -0.0002825 ] [ -0.0006628 -0.0012491 0.0021243 ] ] } "species" { "source-value" [ "Si" "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" -3.057958999186601e-18 "source-value" -19.086279 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -2.037735016240989e-08 -4.094225849006308e-09 -1.89562422506683e-08 ] [ -1.038220832382903e-08 -1.163825102790672e-08 1.149818842728106e-08 ] [ 1.94327093902688e-08 -1.832996406679289e-08 -3.891142271872128e-10 ] [ 4.267252272298956e-09 1.129135511598356e-08 2.639387665345877e-08 ] [ 1.138850774169797e-08 2.129877042856806e-09 -2.378950939673388e-09 ] [ -4.349098663884213e-09 1.447498981061168e-08 -1.846223800621185e-08 ] [ 2.018774585740416e-11 6.166219134471527e-09 2.294480343000922e-09 ] ] "source-value" [ [ -12.7185417 -2.5554148 -11.8315559 ] [ -6.4800648 -7.264025 7.1766048 ] [ 12.1289433 -11.4406638 -0.242866 ] [ 2.6634094 7.0475096 16.4737622 ] [ 7.1081475 1.3293647 -1.4848244 ] [ -2.7144939 9.0345781 -11.5232227 ] [ 0.0126002 3.8486513 1.432102 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -7.949854273901783e-19 "source-value" -4.9619088 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.931726e-10 1.779285e-10 1.793394e-10 ] [ 2.022352e-10 7.174538e-11 3.630998e-10 ] [ 4.124201e-10 9.725878e-11 2.711634e-10 ] [ 3.467636e-10 2.844975e-10 3.645464e-10 ] [ 5.471294000000001e-10 3.704408e-10 2.165903e-10 ] [ 3.262896e-10 3.451778e-10 1.529715e-10 ] [ 3.831227000000001e-10 5.454570000000001e-10 3.339943e-10 ] ] "source-value" [ [ 1.931726 1.779285 1.793394 ] [ 2.022352 0.7174538 3.630998 ] [ 4.124201 0.9725878 2.711634 ] [ 3.467636 2.844975 3.645464 ] [ 5.471294 3.704408 2.165903 ] [ 3.262896 3.451778 1.529715 ] [ 3.831227 5.45457 3.339943 ] ] } "instance-id" 1 }