{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 7.059666e-11 3.78944e-11 1.8542856e-10 ] [ 1.21824e-11 2.7014417e-10 1.9852286e-10 ] [ 2.671691e-10 9.60392e-11 2.549995e-11 ] [ 3.0569426e-10 9.073478000000001e-11 2.8245803e-10 ] [ 2.0876291e-10 3.2827977e-10 3.865731e-11 ] [ 2.4724996e-10 3.2296328e-10 2.9565077e-10 ] ] "source-value" [ [ 0.7059666 0.378944 1.8542856 ] [ 0.121824 2.7014417 1.9852286 ] [ 2.671691 0.960392 0.2549995 ] [ 3.0569426 0.9073478 2.8245803 ] [ 2.0876291 3.2827977 0.3865731 ] [ 2.4724996 3.2296328 2.9565077 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -1.10117599147584e-12 -1.2649184421216e-12 -4.14595244164416e-12 ] [ 1.84875160274112e-12 -1.55667480476928e-12 -2.72994874418112e-12 ] [ -2.93166278073984e-12 -1.5477026156928e-12 2.9552147770656e-12 ] [ 9.3839484680256e-13 1.39165061282688e-12 -4.2489723983616e-13 ] [ -2.13762404747136e-12 -3.2187728311872e-13 3.5696495111424e-12 ] [ 3.38331637014336e-12 3.29952253287552e-12 7.757739197913601e-13 ] ] "source-value" [ [ -0.0006873 -0.0007895 -0.0025877 ] [ 0.0011539 -0.0009716 -0.0017039 ] [ -0.0018298 -0.000966 0.0018445 ] [ 0.0005857 0.0008686 -0.0002652 ] [ -0.0013342 -0.0002009 0.002228 ] [ 0.0021117 0.0020594 0.0004842 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -2.426994608913007e-18 "source-value" -15.148109 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -3.683657835995934e-08 -3.713170650330551e-08 -8.981329974754652e-09 ] [ -4.31432616005177e-08 2.161613678341092e-08 1.8994781968411e-08 ] [ 6.449120234892512e-08 -4.419823081824967e-08 -2.011094936631e-08 ] [ 2.189143046084455e-08 -4.756185884098834e-08 4.866605974192425e-08 ] [ -3.405957368842533e-08 5.987026542192536e-08 -5.69560686093995e-08 ] [ 2.76567808391327e-08 4.740539395720723e-08 1.838750624012892e-08 ] ] "source-value" [ [ -22.991584 -23.1757885 -5.6057053 ] [ -26.9279061 13.4917315 11.8556105 ] [ 40.2522428 -27.5863661 -12.5522674 ] [ 13.6635563 -29.6857776 30.3749656 ] [ -21.258314 37.3680808 -35.5491822 ] [ 17.262005 29.5881199 11.4765788 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 4.687221377067197e-18 "source-value" 29.255335 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 9.701738e-11 4.35353e-11 8.614305e-11 ] [ 7.85215e-11 2.880742e-10 2.663197e-10 ] [ 2.41347e-10 1.4145e-10 9.828772e-11 ] [ 2.657499e-10 1.219941e-10 2.828683e-10 ] [ 1.63309e-10 2.566255e-10 2.71655e-11 ] [ 2.657105e-10 2.943765e-10 2.654332e-10 ] ] "source-value" [ [ 0.9701738 0.435353 0.8614305 ] [ 0.785215 2.880742 2.663197 ] [ 2.41347 1.4145 0.9828772 ] [ 2.657499 1.219941 2.828683 ] [ 1.63309 2.566255 0.271655 ] [ 2.657105 2.943765 2.654332 ] ] } "instance-id" 1 }