{ "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" [ [ 0.8494568 1.09498 0.2360667 ] [ 0.557157 2.835915 1.114432 ] [ 0.135541 1.869398 2.917972 ] [ 1.620291 0.3348641 1.837353 ] [ 2.814436 1.836887 0.4161362 ] [ 2.451507 2.913738 2.050042 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.494568e-11 1.09498e-10 2.360667e-11 ] [ 5.57157e-11 2.835915e-10 1.114432e-10 ] [ 1.35541e-11 1.869398e-10 2.917972e-10 ] [ 1.620291e-10 3.348641e-11 1.837353e-10 ] [ 2.814436e-10 1.836887e-10 4.161362e-11 ] [ 2.451507e-10 2.913738e-10 2.050042e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -8.4881874 -9.0119764 -17.2611609 ] [ -14.5849947 17.4697068 -2.5040627 ] [ -6.2301072 -0.6960371 10.1066532 ] [ 2.8457995 -19.2797136 10.1727843 ] [ 15.826879 -0.7833372 -9.2672084 ] [ 10.6306108 12.3013574 8.7529946 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.359957540524914e-08 -1.443877789528135e-08 -2.765542844184709e-08 ] [ -2.336773752283191e-08 2.798955580719079e-08 -4.011950714957324e-09 ] [ -9.98173210091775e-09 -1.115174368829432e-09 1.619264347157351e-08 ] [ 4.55947342638433e-09 -3.08895063856398e-08 1.629859717390129e-08 ] [ 2.535745551403048e-08 -1.255044548042934e-09 -1.484770463856137e-08 ] [ 1.703211608858398e-08 1.970894723038507e-08 1.402384331010865e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 1.8824773 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.016061119246708e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.1702312 1.079857 0.1766936 ] [ 0.4570321 2.9384096 1.4374783 ] [ 0.0917022 1.5467719 3.2158253 ] [ 0.7833901 -0.2557082 1.9930804 ] [ 3.3088572 1.8869874 0.2630856 ] [ 2.617176 3.6894643 1.4858388 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.1702312e-10 1.079857e-10 1.766936e-11 ] [ 4.570321e-11 2.9384096e-10 1.4374783e-10 ] [ 9.17022e-12 1.5467719e-10 3.2158253e-10 ] [ 7.833901e-11 -2.557082e-11 1.9930804e-10 ] [ 3.3088572e-10 1.8869874e-10 2.630856e-11 ] [ 2.617176e-10 3.6894643e-10 1.4858388e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 8.4e-06 -4.8e-06 -1.03e-05 ] [ 1.62e-05 -1.27e-05 -1e-06 ] [ -5e-07 -6.2e-06 6.5e-06 ] [ -5.7e-06 1.75e-05 1e-07 ] [ -1.81e-05 6.3e-06 8.9e-06 ] [ -3e-07 -1e-07 -4.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.345828361472e-14 -7.69044777984e-15 -1.650241919424e-14 ] [ 2.595526125696e-14 -2.034764308416e-14 -1.6021766208e-15 ] [ -8.010883104e-16 -9.93349504896e-15 1.04141480352e-14 ] [ -9.13240673856e-15 2.8038090864e-14 1.6021766208e-16 ] [ -2.899939683648e-14 1.009371271104e-14 1.425937192512e-14 ] [ -4.8065298624e-16 -1.6021766208e-16 -6.72914180736e-15 ] ] } "relaxed-potential-energy" { "source-value" -11.423131 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.830187342453573e-18 } }