{ "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" [ [ 2.487281 5.921696 4.58109 ] [ 2.384555 3.657598 3.132891 ] [ 3.419185 2.494172 4.950415 ] [ 4.429689 2.154563 3.12196 ] [ 4.178368 4.562199 4.289341 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.487281e-10 5.921696e-10 4.58109e-10 ] [ 2.384555e-10 3.657598e-10 3.132891e-10 ] [ 3.419185e-10 2.494172e-10 4.950414999999999e-10 ] [ 4.429689e-10 2.154563e-10 3.12196e-10 ] [ 4.178368e-10 4.562199e-10 4.289341000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -24.007432 20.75803 5.117489 ] [ -18.548222 0.1448623 -13.3414953 ] [ -25.9886684 -3.2128346 55.3190838 ] [ 30.9163878 -14.4240667 -48.1711048 ] [ 37.6279346 -3.265991 1.0760274 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.846414659274389e-08 3.325803063387102e-08 8.199121300552024e-09 ] [ -2.971752789064474e-08 2.320949922074982e-10 -2.137543203228082e-08 ] [ -4.163843725925416e-08 -5.147528525026736e-09 8.863094347864793e-08 ] [ 4.953351414084266e-08 -2.310990263399749e-08 -7.717861854452525e-08 ] [ 6.028659760180014e-08 -5.232694467054294e-09 1.723985957823772e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 0.78879172 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.26378366287667e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.5097725 6.080391 4.0257861 ] [ 2.0816339 3.5933749 3.4049064 ] [ 3.3718059 2.1064598 5.2308098 ] [ 4.4673661 2.5280192 2.7863051 ] [ 4.4684996 4.4819831 4.6278897 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5097725e-10 6.080391e-10 4.0257861e-10 ] [ 2.0816339e-10 3.5933749e-10 3.4049064e-10 ] [ 3.3718059e-10 2.1064598e-10 5.2308098e-10 ] [ 4.4673661e-10 2.5280192e-10 2.7863051e-10 ] [ 4.4684996e-10 4.4819831e-10 4.6278897e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 9.2e-06 -3.5e-06 -5.9e-06 ] [ -1.91e-05 7.3e-06 -8e-07 ] [ -6e-07 -2.96e-05 5.9e-06 ] [ 5.7e-06 1.76e-05 1.76e-05 ] [ 4.8e-06 8.3e-06 -1.68e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.47400250328e-14 -5.607618218999999e-15 -9.452842140600001e-15 ] [ -3.06015737094e-14 1.16958894282e-14 -1.2817413072e-15 ] [ -9.613059803999998e-16 -4.74244283664e-14 9.452842140600001e-15 ] [ 9.1324068138e-15 2.81983087584e-14 2.81983087584e-14 ] [ 7.690447843199998e-15 1.32980660622e-14 -2.691656745119999e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.624493 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.663537423669656e-18 } }