{ "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" [ [ 1.180338 1.724614 2.454285 ] [ 2.279675 2.151595 5.035575 ] [ 1.206438 3.673046 1.250197 ] [ 2.791298 3.409437 3.168578 ] [ 3.407643 1.775427 1.527211 ] [ 3.723971 4.511514 1.482617 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.180338e-10 1.724614e-10 2.454285e-10 ] [ 2.279675e-10 2.151595e-10 5.035575e-10 ] [ 1.206438e-10 3.673046e-10 1.250197e-10 ] [ 2.791298e-10 3.409437e-10 3.168578e-10 ] [ 3.407643e-10 1.775427e-10 1.527211e-10 ] [ 3.723971e-10 4.511514e-10 1.482617e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.8825645 -0.8267735 2.8829103 ] [ -1.225246 -2.0145553 -0.0028226 ] [ 3.5389198 0.075202 0.1261259 ] [ -2.1904929 0.3345744 0.6499958 ] [ -1.3044553 3.3619036 -0.5794265 ] [ 0.2987098 -0.9303512 -3.0767829 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.414024208248042e-09 -1.324637172396989e-09 4.618931482523514e-09 ] [ -1.963060495928717e-09 -3.22767340296873e-09 -4.52230372987008e-12 ] [ 5.669974566446212e-09 1.204868862374016e-10 2.020759682573587e-10 ] [ -3.509556512408393e-09 5.360472815981875e-10 1.041408074378193e-09 ] [ -2.08996778453865e-09 5.386363349303355e-09 -9.283435917719711e-10 ] [ 4.785858579638439e-10 -1.490586941773225e-09 -4.929549629657225e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -18.13798 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.906024750453798e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.9139268 1.9491695 2.8042013 ] [ 2.7718305 1.7310251 4.3416314 ] [ 1.5428357 3.4798471 1.0360799 ] [ 2.3359454 3.875543 3.3192101 ] [ 3.2200616 1.9650059 1.9797133 ] [ 3.804763 4.2450425 1.4376269 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.139268e-11 1.9491695e-10 2.8042013e-10 ] [ 2.7718305e-10 1.7310251e-10 4.3416314e-10 ] [ 1.5428357e-10 3.4798471e-10 1.0360799e-10 ] [ 2.3359454e-10 3.875543e-10 3.3192101e-10 ] [ 3.2200616e-10 1.9650059e-10 1.9797133e-10 ] [ 3.804763e-10 4.2450425e-10 1.4376269e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.35e-05 1.49e-05 -1.02e-05 ] [ 2.12e-05 -9.3e-06 -6.2e-06 ] [ -2.17e-05 -2.8e-06 8e-07 ] [ -3.72e-05 4.65e-05 6.2e-06 ] [ -7.7e-06 -6.23e-05 -5.3e-06 ] [ 2.2e-05 1.29e-05 1.47e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.76511505888e-14 2.387243164992e-14 -1.634220153216e-14 ] [ 3.396614436096001e-14 -1.490024257344e-14 -9.93349504896e-15 ] [ -3.476723267136e-14 -4.48609453824e-15 1.28174129664e-15 ] [ -5.960097029376001e-14 7.45012128672e-14 9.93349504896e-15 ] [ -1.233675998016e-14 -9.981560347584e-14 -8.491536090240001e-15 ] [ 3.52478856576e-14 2.066807840832e-14 2.355199632576e-14 ] ] } "relaxed-potential-energy" { "source-value" -23.902638 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.829624777904567e-18 } }