{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.875077 1.739271 0.5500127 ] [ 2.247142 4.095662 1.890424 ] [ 4.370849 2.938246 1.693427 ] [ 3.902852 1.049683 3.036341 ] [ 5.923496 0.662055 4.457524 ] [ 5.031061 2.817229 4.209838 ] [ 4.680107 5.055758 2.976326 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.875077e-10 1.739271e-10 5.500127000000001e-11 ] [ 2.247142e-10 4.095662e-10 1.890424e-10 ] [ 4.370849e-10 2.938246e-10 1.693427e-10 ] [ 3.902852e-10 1.049683e-10 3.036341e-10 ] [ 5.923496e-10 6.62055e-11 4.457524e-10 ] [ 5.031061e-10 2.817229e-10 4.209838000000001e-10 ] [ 4.680106999999999e-10 5.055758e-10 2.976326e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -17.0962792 -13.5817325 -14.0170231 ] [ -1.2468766 2.2263627 0.8344474 ] [ 18.8886985 13.6872759 5.7258217 ] [ -7.2743267 -9.5559783 -2.1374747 ] [ 8.0260658 -12.0946105 3.4553353 ] [ -0.5162576 16.1778196 5.5834624 ] [ -0.7810243 3.1408633 0.555431 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.739125883690933e-08 -2.176033428145953e-08 -2.245774670403354e-08 ] [ -1.997716537542594e-09 3.567026267361164e-09 1.336932115567346e-09 ] [ 3.026303113404003e-08 2.192943344941928e-08 9.17377766260931e-09 ] [ -1.165475617080122e-08 -1.531036502113213e-08 -3.424611991891494e-09 ] [ 1.285917498176245e-08 -1.93777021807822e-08 5.536057434684955e-09 ] [ -8.271358570303181e-10 2.591972433864e-08 8.945692920395858e-09 ] [ -1.251338873736686e-09 5.032217748388736e-09 8.898985626675648e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -15.67207 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.510942415354106e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.4656542 1.7861115 1.0633939 ] [ 2.58404 4.3798722 1.236247 ] [ 4.8601278 2.8925484 1.676059 ] [ 3.8063263 0.7713065 3.0851727 ] [ 6.1942101 0.5940926 4.1623491 ] [ 4.9203015 2.8741059 4.4314038 ] [ 4.1999242 5.059867 3.1592673 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4656542e-10 1.7861115e-10 1.0633939e-10 ] [ 2.58404e-10 4.3798722e-10 1.236247e-10 ] [ 4.8601278e-10 2.8925484e-10 1.676059e-10 ] [ 3.8063263e-10 7.713065000000001e-11 3.0851727e-10 ] [ 6.194210100000001e-10 5.940926e-11 4.1623491e-10 ] [ 4.920301500000001e-10 2.8741059e-10 4.4314038e-10 ] [ 4.1999242e-10 5.059867e-10 3.1592673e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5.5e-06 -2.15e-05 5.1e-06 ] [ -6.13e-05 3.63e-05 -3.45e-05 ] [ 6.4e-05 1.17e-05 -1.18e-05 ] [ -4.3e-06 -6.6e-06 3.56e-05 ] [ 1.28e-05 -1.92e-05 3.8e-06 ] [ -3.67e-05 1.57e-05 -4.41e-05 ] [ 3.09e-05 -1.64e-05 4.59e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.8119714144e-15 -3.44467973472e-14 8.17110076608e-15 ] [ -9.821342685504e-14 5.815901133504e-14 -5.52750934176e-14 ] [ 1.025393037312e-13 1.874546646336e-14 -1.890568412544e-14 ] [ -6.889359469440001e-15 -1.057436569728e-14 5.703748770048e-14 ] [ 2.050786074624e-14 -3.076179111936e-14 6.08827115904e-15 ] [ -5.879988198335999e-14 2.515417294656e-14 -7.065598897728e-14 ] [ 4.950725758272e-14 -2.627569658112e-14 7.353990689472e-14 ] ] } "relaxed-potential-energy" { "source-value" -24.084037 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.858688101588217e-18 } }