{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.3288529 1.174724 0.8712814 ] [ 1.395659 1.176494 2.521247 ] [ 2.395391 0.4245255 0.3168768 ] [ 2.017962 2.536207 0.5333854 ] [ 2.744316 1.992854 1.84914 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.288529e-11 1.174724e-10 8.712814e-11 ] [ 1.395659e-10 1.176494e-10 2.521247e-10 ] [ 2.395391e-10 4.245255e-11 3.168768e-11 ] [ 2.017962e-10 2.536207e-10 5.333854e-11 ] [ 2.744316e-10 1.992854e-10 1.84914e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -29.7267714 -7.047697 -15.0074174 ] [ -19.2522733 -14.0997774 28.50814 ] [ 6.2769508 -13.7728982 -9.1468147 ] [ -16.8307762 27.2555094 -38.0840597 ] [ 59.5328701 7.6648632 33.7301518 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.762753854133946e-08 -1.12916554569119e-08 -2.404453349496503e-08 ] [ -3.084554243264207e-08 -2.259033389488127e-08 4.567507578680076e-08 ] [ 1.005678390452761e-08 -2.206661567850066e-08 -1.465481278786772e-08 ] [ -2.696587635972331e-08 4.366814030844735e-08 -6.101739057920104e-08 ] [ 9.538217342917723e-08 1.228046472184647e-08 5.404166107523304e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 17.642261 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.826601834512947e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.3516353 1.0621981 0.8765554 ] [ 1.0116668 1.1708172 3.1924809 ] [ 2.5978867 0.4251679 -0.0408816 ] [ 1.8974764 2.8543283 0.0448141 ] [ 3.0235156 1.792293 2.0189619 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.516353e-11 1.0621981e-10 8.765554000000001e-11 ] [ 1.0116668e-10 1.1708172e-10 3.1924809e-10 ] [ 2.5978867e-10 4.251679e-11 -4.08816e-12 ] [ 1.8974764e-10 2.8543283e-10 4.481410000000001e-12 ] [ 3.0235156e-10 1.792293e-10 2.0189619e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.31e-05 4.05e-05 7.7e-06 ] [ -2.66e-05 -1.19e-05 -2.39e-05 ] [ -1.07e-05 4.52e-05 3.56e-05 ] [ -2.68e-05 -6.62e-05 1.59e-05 ] [ 2.1e-05 -7.5e-06 -3.53e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.90538129254e-14 6.4888153677e-14 1.23367600818e-14 ] [ -4.26178984644e-14 -1.90659019446e-14 -3.82920215526e-14 ] [ -1.71432899838e-14 7.24183838568e-14 5.703748817039999e-14 ] [ -4.293833379119999e-14 -1.060640931708e-13 2.54746084806e-14 ] [ 3.364570931399999e-14 -1.2016324755e-14 -5.655683518019999e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.674822 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.710295038050915e-18 } }