{ "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" [ [ 0.4467477 0.434499 0.6495355 ] [ 1.045521 0.0858534 2.314559 ] [ 1.192787 2.478944 2.855919 ] [ 2.996113 0.2043739 2.091587 ] [ 2.935004 2.164039 0.1200611 ] [ 2.862412 2.380014 2.301415 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.467477000000001e-11 4.34499e-11 6.495355000000001e-11 ] [ 1.045521e-10 8.58534e-12 2.314559e-10 ] [ 1.192787e-10 2.478944e-10 2.855919e-10 ] [ 2.996113e-10 2.043739e-11 2.091587e-10 ] [ 2.935004e-10 2.164039e-10 1.200611e-11 ] [ 2.862412e-10 2.380014e-10 2.301415e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -8.0420915 2.7472571 -16.9241523 ] [ -6.4150842 -6.1949495 16.6949339 ] [ -19.8750755 -0.4456137 6.2019152 ] [ 10.6714706 -0.5036334 -1.5346729 ] [ -0.004244 -1.5859877 -0.5594815 ] [ 23.6650245 5.9829273 -3.8785424 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.288485108979001e-08 4.401591133210601e-09 -2.711548136531736e-08 ] [ -1.027809801038258e-08 -9.925403337709982e-09 2.674823300075449e-08 ] [ -3.184338156508586e-08 -7.139518579302858e-10 9.936563619489437e-09 ] [ 1.709758084573796e-08 -8.069096655819755e-10 -2.458817061213018e-09 ] [ -6.799637634696e-12 -2.541032434751402e-09 -8.963881864552709e-10 ] [ 3.791554929693754e-08 9.585706322980707e-09 -6.214110007258281e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -7.1399938 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.143953123326487e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.1648628 0.1487308 0.415355 ] [ 0.9411582 0.1918574 2.3980525 ] [ 0.9630712 2.408545 3.0205995 ] [ 3.2008603 0.3080809 1.8271753 ] [ 3.3431563 2.0311924 0.1900713 ] [ 3.1952015 2.6593169 2.481823 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.648628e-11 1.487308e-11 4.15355e-11 ] [ 9.411582e-11 1.918574e-11 2.3980525e-10 ] [ 9.630712e-11 2.408545e-10 3.0205995e-10 ] [ 3.2008603e-10 3.080809e-11 1.8271753e-10 ] [ 3.3431563e-10 2.0311924e-10 1.900713e-11 ] [ 3.1952015e-10 2.6593169e-10 2.481823e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.65e-05 -8.8e-06 -1.61e-05 ] [ -3.9e-06 1.51e-05 2.5e-06 ] [ -3.2e-05 -5.5e-06 2.53e-05 ] [ 2.03e-05 -1.3e-05 4e-06 ] [ 5.8e-06 -1.2e-06 -1.09e-05 ] [ 2.63e-05 1.35e-05 -4.9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.6435914461e-14 -1.40991543792e-14 -2.579504380739999e-14 ] [ -6.248488872599999e-15 2.41928671734e-14 4.005441585e-15 ] [ -5.126965228799999e-14 -8.811971486999999e-15 4.053506884019999e-14 ] [ 3.252418567019999e-14 -2.082829624199999e-14 6.408706535999999e-15 ] [ 9.2926244772e-15 -1.9226119608e-15 -1.74637253106e-14 ] [ 4.21372454742e-14 2.162938455899999e-14 -7.850665506599998e-15 ] ] } "relaxed-potential-energy" { "source-value" -16.622753 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.66325864493534e-18 } }