{ "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" [ [ 0.7607129 0.1029019 2.480933 ] [ 0.9158836 2.552597 0.2381701 ] [ 0.8989231 2.268448 2.632769 ] [ 2.109562 0.2713555 0.0459784 ] [ 2.969591 1.985029 0.1686784 ] [ 2.973458 2.362165 2.304699 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.607129000000001e-11 1.029019e-11 2.480933e-10 ] [ 9.158836e-11 2.552597e-10 2.381701e-11 ] [ 8.989231e-11 2.268448e-10 2.632769e-10 ] [ 2.109562e-10 2.713555e-11 4.59784e-12 ] [ 2.969591e-10 1.985029e-10 1.686784e-11 ] [ 2.973458e-10 2.362165e-10 2.304699e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.7274441 -1.2596016 0.1128574 ] [ -3.0706913 1.5752041 -0.6182871 ] [ -2.684884 0.4718064 1.2984935 ] [ -3.201987 -8.2728474 -1.3086531 ] [ 6.1354851 5.9469972 -1.1110088 ] [ 3.5495213 1.5384413 1.6265981 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.165493929958897e-09 -2.018104235042274e-09 1.808174877642739e-10 ] [ -4.91978981055396e-09 2.523755182008306e-09 -9.906051365622316e-10 ] [ -4.301658374359987e-09 7.559171836238131e-10 2.080415927960765e-09 ] [ -5.130148711505529e-09 -1.325456269172606e-08 -2.096693401557445e-09 ] [ 9.830130784486752e-09 9.528139877803062e-09 -1.780032324863063e-09 ] [ 5.686960041891623e-09 2.464854683333159e-09 2.606097447257701e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -8.0189512 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.284777613597611e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.1999642 0.280052 3.1827141 ] [ -0.234567 3.1880284 0.6728962 ] [ 0.9074738 2.1548588 2.2545948 ] [ 2.7936952 -0.013833 -0.8423631 ] [ 3.8798422 1.4013968 0.4418818 ] [ 3.0817223 2.5319934 2.1615041 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.999642e-11 2.80052e-11 3.1827141e-10 ] [ -2.34567e-11 3.1880284e-10 6.728962000000001e-11 ] [ 9.074738e-11 2.1548588e-10 2.2545948e-10 ] [ 2.7936952e-10 -1.3833e-12 -8.423631e-11 ] [ 3.8798422e-10 1.4013968e-10 4.418818e-11 ] [ 3.0817223e-10 2.5319934e-10 2.1615041e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0612894 0.4830079 -0.0640831 ] [ -0.0041175 -0.0471341 0.3186489 ] [ -0.6040146 -0.2911476 0.0144399 ] [ 0.129743 -0.2129996 -0.3153834 ] [ 0.0407127 0.315699 0.4577838 ] [ 0.376387 -0.2474257 -0.4114061 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.819644378285953e-11 7.738639650417043e-10 -1.026724446083885e-10 ] [ -6.596962236144e-12 -7.551715306244927e-11 5.105318178236372e-10 ] [ -9.677380707418636e-10 -4.664698779220301e-10 2.313527018668992e-11 ] [ 2.078712013124544e-10 -3.412629793597517e-10 -5.052999100684147e-10 ] [ 6.522893610964416e-11 5.058055570099393e-10 7.334505017409831e-10 ] [ 6.030384517730496e-10 -3.964196719250746e-10 -6.591452350745069e-10 ] ] } "relaxed-potential-energy" { "source-value" -12.270123 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.965890420494036e-18 } }