{ "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" [ [ 0.0068904 0.1581444 0.9739303 ] [ 1.486449 0.0094288 0.6635661 ] [ 1.283407 0.7092398 2.988588 ] [ 0.3149749 1.776241 2.685574 ] [ 2.9726 1.648627 0.444947 ] [ 2.196005 2.727691 2.654363 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.8904e-13 1.581444e-11 9.739303e-11 ] [ 1.486449e-10 9.4288e-13 6.635661000000001e-11 ] [ 1.283407e-10 7.092398e-11 2.988588e-10 ] [ 3.149749e-11 1.776241e-10 2.685574e-10 ] [ 2.9726e-10 1.648627e-10 4.44947e-11 ] [ 2.196005e-10 2.727691e-10 2.654363e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -77.9133827 2.6790853 4.6406848 ] [ 68.4502646 -13.7449483 -19.3648658 ] [ 54.5360483 -71.6697013 34.3504624 ] [ -64.7637111 60.7844639 -14.753951 ] [ 5.5532421 6.0892344 -1.7921286 ] [ 14.1375388 15.861866 -3.0802018 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.248310002093832e-07 4.292367832788954e-09 7.435196691061924e-09 ] [ 1.096694136296939e-07 -2.20218348203647e-08 -3.102593524968949e-08 ] [ 8.737638157707958e-08 -1.148275198425794e-07 5.503550777094945e-08 ] [ -1.037629038006654e-07 9.73874469684416e-08 -2.363843535662878e-08 ] [ 8.897274662262297e-09 9.756028994251115e-09 -2.871306544387035e-09 ] [ 2.265083414101289e-08 2.541351086746241e-08 -4.935027311306078e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 46.624881 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 7.470129428578213e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.024129 0.925266 0.4458615 ] [ 1.9435386 -0.5469341 1.0942114 ] [ 1.8504278 0.3448722 3.4017528 ] [ -0.1172037 1.8171183 2.753386 ] [ 2.3503703 1.7986255 0.2041047 ] [ 2.2573223 2.690424 2.5116519 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -2.4129e-12 9.25266e-11 4.458615000000001e-11 ] [ 1.9435386e-10 -5.469341e-11 1.0942114e-10 ] [ 1.8504278e-10 3.448722000000001e-11 3.4017528e-10 ] [ -1.172037e-11 1.8171183e-10 2.753386e-10 ] [ 2.3503703e-10 1.7986255e-10 2.041047e-11 ] [ 2.2573223e-10 2.690424e-10 2.5116519e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2e-05 4.76e-05 1.74e-05 ] [ -3.32e-05 -1.08e-05 1.88e-05 ] [ 1.52e-05 4.57e-05 -6.19e-05 ] [ 5.09e-05 -4.05e-05 4e-06 ] [ 2.47e-05 -2.56e-05 4.84e-05 ] [ -7.76e-05 -1.63e-05 -2.67e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.2043532416e-14 7.626360715008e-14 2.787787320192e-14 ] [ -5.319226381056e-14 -1.730350750464e-14 3.012092047104e-14 ] [ 2.435308463616e-14 7.321947157056e-14 -9.917473282752e-14 ] [ 8.155078999872e-14 -6.488815314240001e-14 6.4087064832e-15 ] [ 3.957376253376001e-14 -4.101572149248001e-14 7.754534844671999e-14 ] [ -1.2432890577408e-13 -2.611547891904e-14 -4.277811577536e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.599118 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.659471878550046e-18 } }