{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.3527209 0.4565602 1.167471 ] [ 0.6414148 2.926013 0.4472085 ] [ 0.2560781 2.125953 2.651252 ] [ 2.793307 0.1807352 2.367537 ] [ 2.546309 2.149048 0.8335699 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.527209e-11 4.565602e-11 1.167471e-10 ] [ 6.414148e-11 2.926013000000001e-10 4.472085e-11 ] [ 2.560781e-11 2.125953e-10 2.651252e-10 ] [ 2.793307e-10 1.807352e-11 2.367537e-10 ] [ 2.546309e-10 2.149048e-10 8.335699e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.2105552 -0.3902555 -0.0184486 ] [ -2.5895425 0.4872306 -0.117958 ] [ 0.3298519 0.3329784 0.321626 ] [ -1.7924255 1.1913571 -1.1085895 ] [ 2.8415609 -1.6213106 0.9233701 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.939523255607197e-09 -6.252582433899869e-10 -2.95579158500124e-11 ] [ -4.148904486249944e-09 7.806294826898004e-10 -1.88989551393372e-10 ] [ 5.284810068605045e-10 5.334902121067056e-10 5.15301662086884e-10 ] [ -2.871782254285767e-09 1.908764508370001e-09 -1.776156193597743e-09 ] [ 4.55268247806801e-09 -2.59762595977652e-09 1.479401998754243e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -11.839383 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.896878280357682e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.6857039 0.54535 0.8789546 ] [ 0.5916475 2.9310952 0.713854 ] [ 0.2650994 1.8577493 2.8356144 ] [ 2.3604248 0.715399 2.5802009 ] [ 2.6869543 1.7887158 0.4584144 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.857039000000001e-11 5.4535e-11 8.789546e-11 ] [ 5.916475000000001e-11 2.9310952e-10 7.13854e-11 ] [ 2.650994e-11 1.8577493e-10 2.8356144e-10 ] [ 2.3604248e-10 7.15399e-11 2.5802009e-10 ] [ 2.6869543e-10 1.7887158e-10 4.584144e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.81e-05 -6.4e-06 -1.96e-05 ] [ -2.29e-05 1.42e-05 -4.09e-05 ] [ -2.5e-06 1.16e-05 3.21e-05 ] [ 2.95e-05 -2.93e-05 1.27e-05 ] [ 1.41e-05 9.9e-06 1.57e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.899939707539999e-14 -1.02539304576e-14 -3.140266202639999e-14 ] [ -3.66898449186e-14 2.27509082028e-14 -6.552902433059999e-14 ] [ -4.005441585e-15 1.85852489544e-14 5.14298699514e-14 ] [ 4.726421070299999e-14 -4.69437753762e-14 2.03476432518e-14 ] [ 2.25906905394e-14 1.58615486766e-14 2.515417315379999e-14 ] ] } "relaxed-potential-energy" { "source-value" -13.3401 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.13731965152234e-18 } }