{ "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" [ [ 1.93515 2.579075 2.191315 ] [ 2.854208 3.00929 4.274511 ] [ 2.977973 4.356331 0.9884451 ] [ 4.176928 2.41177 1.411978 ] [ 5.404797 4.627409 0.9176814 ] [ 4.282265 4.172591 2.948671 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.93515e-10 2.579075e-10 2.191315e-10 ] [ 2.854208e-10 3.00929e-10 4.274511e-10 ] [ 2.977973e-10 4.356331e-10 9.884451e-11 ] [ 4.176928e-10 2.41177e-10 1.411978e-10 ] [ 5.404797000000001e-10 4.627409e-10 9.176814e-11 ] [ 4.282265e-10 4.172591e-10 2.948671e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 7.8460334 4.1513752 0.0323926 ] [ 0.5671154 0.4521614 -5.3288188 ] [ 5.6441119 -5.2753642 5.6844206 ] [ -3.5649214 8.4315605 3.0916653 ] [ -7.3723623 -4.2799172 3.9226441 ] [ -3.1199771 -3.4798157 -7.4023038 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.257073127949594e-08 6.651236289608925e-09 5.189866640692608e-11 ] [ 9.086190351756404e-10 7.244424239081972e-10 -8.537708897839512e-09 ] [ 9.042864131359069e-09 -8.452065187445295e-09 9.107445788113909e-09 ] [ -5.711633722069605e-09 1.350884910996076e-08 4.953393862998618e-09 ] [ -1.181182651712732e-08 -6.857183276799798e-09 6.284768668739058e-09 ] [ -4.998754367051384e-09 -5.575279359232787e-09 -1.1859798088419e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -30.282953 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.851863930538523e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0142934 3.1362031 2.2968131 ] [ 3.4406221 2.5591323 3.8958107 ] [ 3.1214607 4.1893326 0.6939401 ] [ 4.0769397 2.5116682 1.7814388 ] [ 5.266409 4.2958182 1.2525732 ] [ 3.7115961 4.4643115 2.8120256 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0142934e-10 3.1362031e-10 2.2968131e-10 ] [ 3.4406221e-10 2.5591323e-10 3.8958107e-10 ] [ 3.1214607e-10 4.1893326e-10 6.939401e-11 ] [ 4.0769397e-10 2.5116682e-10 1.7814388e-10 ] [ 5.266409e-10 4.2958182e-10 1.2525732e-10 ] [ 3.7115961e-10 4.4643115e-10 2.8120256e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.1e-05 -7.47e-05 4.2e-06 ] [ -2.42e-05 -3.5e-06 3.79e-05 ] [ -3.71e-05 6.73e-05 -4.81e-05 ] [ -4e-07 -5.05e-05 -2.09e-05 ] [ 1.7e-05 -1.94e-05 1.11e-05 ] [ 3.36e-05 8.09e-05 1.59e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.76239428288e-14 -1.1968259357376e-13 6.72914180736e-15 ] [ -3.877267422336e-14 -5.6076181728e-15 6.072249392832e-14 ] [ -5.944075263168e-14 1.0782648657984e-13 -7.706469546047999e-14 ] [ -6.408706483200001e-16 -8.090991935040001e-14 -3.348549137472e-14 ] [ 2.72370025536e-14 -3.108222644352e-14 1.778416049088e-14 ] [ 5.383313445888e-14 1.2961608862272e-13 2.547460827072e-14 ] ] } "relaxed-potential-energy" { "source-value" -39.006818 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.249581185140063e-18 } }