{ "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" [ [ 2.263215 2.218791 2.823685 ] [ 2.787552 3.729015 0.8142493 ] [ 2.212325 4.309555 3.289264 ] [ 3.882235 1.940561 0.9401229 ] [ 4.958804 1.525412 3.341241 ] [ 4.281489 4.073298 2.625609 ] [ 3.697667 3.229021 4.691712 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.263215e-10 2.218791e-10 2.823685e-10 ] [ 2.787552e-10 3.729015e-10 8.142493e-11 ] [ 2.212325e-10 4.309555e-10 3.289264e-10 ] [ 3.882235e-10 1.940561e-10 9.401229e-11 ] [ 4.958804e-10 1.525412e-10 3.341241e-10 ] [ 4.281489e-10 4.073298000000001e-10 2.625609e-10 ] [ 3.697667e-10 3.229021e-10 4.691712e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.1403559 -4.3440014 -1.043888 ] [ -2.2546262 3.6720011 -0.8335599 ] [ -4.3003539 4.4096715 1.3406037 ] [ 2.0054481 -4.008871 0.7759011 ] [ -0.988016 0.9362298 0.0273408 ] [ 4.6498821 1.0492974 -2.0614154 ] [ 1.0280219 -1.7143273 1.7950176 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.248749415713427e-10 -6.959857483802469e-09 -1.67249294833367e-09 ] [ -3.612309386283145e-09 5.883194313971883e-09 -1.335510183816386e-09 ] [ -6.889926479746102e-09 7.065072582708067e-09 2.147883905897977e-09 ] [ 3.213082060047781e-09 -6.422919392003117e-09 1.243130602473003e-09 ] [ -1.582976136176333e-09 1.50000549725626e-09 4.380479055396864e-11 ] [ 7.449932390096408e-09 1.681159762546226e-09 -3.30275155963708e-09 ] [ 1.647072653850395e-09 -2.746655120459188e-09 2.875935232644526e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -17.072098 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.735251628360644e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0069817 1.5657188 2.8282179 ] [ 3.2454803 4.0117764 0.9577284 ] [ 2.2169227 3.8988804 3.172353 ] [ 3.6426822 1.7072517 1.0868907 ] [ 4.3275853 1.3110582 3.3551894 ] [ 4.362464 5.1183579 2.7375582 ] [ 4.2811708 3.4126095 4.3879457 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0069817e-10 1.5657188e-10 2.8282179e-10 ] [ 3.2454803e-10 4.0117764e-10 9.577284000000001e-11 ] [ 2.2169227e-10 3.8988804e-10 3.172353e-10 ] [ 3.6426822e-10 1.7072517e-10 1.0868907e-10 ] [ 4.3275853e-10 1.3110582e-10 3.3551894e-10 ] [ 4.362464e-10 5.1183579e-10 2.7375582e-10 ] [ 4.2811708e-10 3.4126095e-10 4.3879457e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5.5e-06 1.62e-05 -2.43e-05 ] [ 1.46e-05 -2.45e-05 -3.64e-05 ] [ -4.13e-05 1.18e-05 3.06e-05 ] [ 9.5e-06 1.2e-05 3.85e-05 ] [ -5e-07 -4.43e-05 -1.94e-05 ] [ -1.69e-05 7.2e-06 1.5e-05 ] [ 4e-05 2.16e-05 -4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.8119714144e-15 2.595526125696e-14 -3.893289188544e-14 ] [ 2.339177866368e-14 -3.92533272096e-14 -5.831922899712e-14 ] [ -6.616989443904001e-14 1.890568412544e-14 4.902660459647999e-14 ] [ 1.52206778976e-14 1.92261194496e-14 6.16837999008e-14 ] [ -8.010883104e-16 -7.097642430144e-14 -3.108222644352e-14 ] [ -2.707678489152e-14 1.153567166976e-14 2.4032649312e-14 ] [ 6.4087064832e-14 3.460701500928e-14 -6.4087064832e-15 ] ] } "relaxed-potential-energy" { "source-value" -22.244274 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.56392557494693e-18 } }