{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.072399 2.177963 4.557602 ] [ 2.377271 3.879759 3.040396 ] [ 5.261436 0.7705425 2.642102 ] [ 4.650297 3.074511 2.607434 ] [ 3.240336 1.703827 1.872622 ] [ 3.483569 0.4560924 3.818111 ] [ 3.60342 3.885532 5.130911 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.072399e-10 2.177963e-10 4.557602e-10 ] [ 2.377271e-10 3.879759e-10 3.040396e-10 ] [ 5.261436e-10 7.705425e-11 2.642102e-10 ] [ 4.650297000000001e-10 3.074511e-10 2.607434e-10 ] [ 3.240336e-10 1.703827e-10 1.872622e-10 ] [ 3.483569e-10 4.560924000000001e-11 3.818111e-10 ] [ 3.60342e-10 3.885532e-10 5.130911000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.3318705 -1.4245486 2.762899 ] [ -1.504858 1.5162693 -1.2502591 ] [ 3.6705507 -1.7809095 -0.6209244 ] [ 3.8995345 4.4198969 -1.7152804 ] [ -1.9861464 -0.2598557 -3.2818464 ] [ -2.5565322 -3.373697 2.7914957 ] [ 0.8093218 0.9028448 1.3139154 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.736068397833207e-09 -2.282378462113371e-09 4.426652183431699e-09 ] [ -2.411048305223847e-09 2.429331223296782e-09 -2.003135899962449e-09 ] [ 5.880870517001075e-09 -2.853331564660618e-09 -9.948305569642676e-10 ] [ 6.247743007903017e-09 7.081455479526396e-09 -2.748182154996472e-09 ] [ -3.182157327566085e-09 -4.163347273216186e-10 -5.258097575136645e-09 ] [ -4.09601612116239e-09 -5.405258459063098e-09 4.472469147603731e-09 ] [ 1.296676466663773e-09 1.446516830770852e-09 2.10512453558908e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -15.363944 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.461575188008044e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.278575 2.3377718 4.7003205 ] [ 1.3587047 2.8302518 2.5772144 ] [ 5.2161245 0.6213881 3.1492744 ] [ 5.0920454 2.949312 2.7472265 ] [ 3.3076155 3.2538701 1.2242954 ] [ 3.267213 0.1977676 4.5021919 ] [ 4.1684499 3.7578655 4.7686549 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.278575e-10 2.3377718e-10 4.7003205e-10 ] [ 1.3587047e-10 2.8302518e-10 2.5772144e-10 ] [ 5.216124500000001e-10 6.213881e-11 3.1492744e-10 ] [ 5.0920454e-10 2.949312e-10 2.7472265e-10 ] [ 3.3076155e-10 3.2538701e-10 1.2242954e-10 ] [ 3.267213e-10 1.977676e-11 4.5021919e-10 ] [ 4.1684499e-10 3.7578655e-10 4.7686549e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.37e-05 -8.3e-06 -2e-05 ] [ -3.9e-06 2.4e-06 1.05e-05 ] [ 7.6e-06 -1.54e-05 -3.2e-06 ] [ -1.4e-06 -2.1e-06 1.42e-05 ] [ -7.7e-06 8.8e-06 -2e-05 ] [ -4.9e-06 3e-07 9.6e-06 ] [ -3.3e-06 1.43e-05 8.9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.194981970496e-14 -1.329806595264e-14 -3.2043532416e-14 ] [ -6.24848882112e-15 3.84522388992e-15 1.68228545184e-14 ] [ 1.217654231808e-14 -2.467351996032e-14 -5.126965186560001e-15 ] [ -2.24304726912e-15 -3.36457090368e-15 2.275090801536e-14 ] [ -1.233675998016e-14 1.409915426304e-14 -3.2043532416e-14 ] [ -7.850665441919999e-15 4.8065298624e-16 1.538089555968e-14 ] [ -5.28718284864e-15 2.291112567744e-14 1.425937192512e-14 ] ] } "relaxed-potential-energy" { "source-value" -21.442861 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.435525057726411e-18 } }