{ "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" [ [ 1.178267 0.166744 1.149708 ] [ 0.7840536 2.31607 1.236295 ] [ 0.8079908 1.595267 2.952936 ] [ 2.817536 1.157767 1.902801 ] [ 1.934708 2.772369 0.0108268 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.178267e-10 1.66744e-11 1.149708e-10 ] [ 7.840536e-11 2.31607e-10 1.236295e-10 ] [ 8.079908000000001e-11 1.595267e-10 2.952936e-10 ] [ 2.817536e-10 1.157767e-10 1.902801e-10 ] [ 1.934708e-10 2.772369e-10 1.08268e-12 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -7.80065 -17.4617489 -3.2681331 ] [ -20.0398038 6.9772222 -0.1288473 ] [ -3.1288582 -4.599694 20.8150167 ] [ 12.6143267 2.744151 2.3227751 ] [ 18.3549853 12.3400698 -19.7408115 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.249801905704352e-08 -2.797680584586012e-08 -5.236126446482629e-09 ] [ -3.2107305133779e-08 1.117874228696674e-08 -2.064361317132038e-10 ] [ -5.012983457838371e-09 -7.369522189634035e-09 3.334933311830157e-08 ] [ 2.021037932587321e-08 4.396614576144941e-09 3.721495960596382e-09 ] [ 2.940792832278767e-08 1.977097133260013e-08 -3.162826666091978e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 4.6677308 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 7.478529159948081e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.8596532 -0.1513329 1.2859576 ] [ 0.2697908 2.3164175 0.9094716 ] [ 0.9849191 1.5528675 3.2514916 ] [ 2.9745006 1.2509089 1.6609374 ] [ 2.4336917 3.039356 0.1447085 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.596532e-11 -1.513329e-11 1.2859576e-10 ] [ 2.697908e-11 2.3164175e-10 9.094716000000001e-11 ] [ 9.849191e-11 1.5528675e-10 3.2514916e-10 ] [ 2.9745006e-10 1.2509089e-10 1.6609374e-10 ] [ 2.4336917e-10 3.039356e-10 1.447085e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.6e-06 -7.3e-06 7.2e-06 ] [ -7e-06 -7.2e-06 -4.2e-06 ] [ 4.5e-06 6e-06 -4.6e-06 ] [ 1.3e-06 -1.37e-05 1.5e-06 ] [ 5.9e-06 2.21e-05 1e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.370012455680001e-15 -1.169588933184e-14 1.153567166976e-14 ] [ -1.12152363456e-14 -1.153567166976e-14 -6.72914180736e-15 ] [ 7.2097947936e-15 9.6130597248e-15 -7.370012455680001e-15 ] [ 2.08282960704e-15 -2.194981970496e-14 2.4032649312e-15 ] [ 9.45284206272e-15 3.540810331968e-14 1.6021766208e-16 ] ] } "relaxed-potential-energy" { "source-value" -10.744302 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.721426947121468e-18 } }