{ "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" [ [ 2.930378 5.180054 2.851976 ] [ 5.738994 3.052967 1.218676 ] [ 3.217774 2.94037 2.40806 ] [ 5.439965 2.572298 3.526756 ] [ 4.050256 4.656384 1.057411 ] [ 5.133306 4.977378 3.451883 ] [ 3.497867 4.079859 4.731393 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.930378e-10 5.180054e-10 2.851976e-10 ] [ 5.738994e-10 3.052967000000001e-10 1.218676e-10 ] [ 3.217774e-10 2.94037e-10 2.40806e-10 ] [ 5.439965e-10 2.572298e-10 3.526756e-10 ] [ 4.050256e-10 4.656384e-10 1.057411e-10 ] [ 5.133306e-10 4.977378e-10 3.451883e-10 ] [ 3.497867e-10 4.079859e-10 4.731393e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -7.3279784 7.0236522 -0.1292171 ] [ 2.7795288 -1.0813196 -1.9417741 ] [ -6.9428364 -10.5029782 -2.2966815 ] [ 2.4330491 -2.3564693 0.0734526 ] [ 1.6066573 1.765415 -7.9039729 ] [ 9.8691369 6.2243584 3.9966542 ] [ -2.4175572 -1.0726586 8.2015388 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.174071567020739e-08 1.125313134747049e-08 -2.070286166275757e-10 ] [ 4.453296060200279e-09 -1.732464982732808e-09 -3.111065065894961e-09 ] [ -1.112365016211924e-08 -1.682762612081206e-08 -3.679689404723875e-09 ] [ 3.898174385278481e-09 -3.775480020092942e-09 1.176840384569741e-10 ] [ 2.574148763697652e-09 2.828506639009632e-09 -1.266356059181678e-08 ] [ 1.581210040865459e-08 9.972521507960094e-09 6.403345920662128e-09 ] [ -3.87335362528671e-09 -1.718588531020059e-09 1.314031371994409e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -6.9143481 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.10780068738929e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.0004684 5.7557787 2.3834928 ] [ 5.6962593 3.7062787 0.9842806 ] [ 3.3594828 2.5713049 2.9421227 ] [ 5.6971354 2.6633798 3.0225268 ] [ 3.4199983 3.944497 1.0473265 ] [ 5.547857 4.32262 4.5931075 ] [ 3.2873388 4.495451 4.2732981 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.0004684e-10 5.7557787e-10 2.3834928e-10 ] [ 5.696259300000001e-10 3.7062787e-10 9.842806e-11 ] [ 3.3594828e-10 2.5713049e-10 2.9421227e-10 ] [ 5.697135399999999e-10 2.6633798e-10 3.0225268e-10 ] [ 3.4199983e-10 3.944497e-10 1.0473265e-10 ] [ 5.547857e-10 4.32262e-10 4.593107500000001e-10 ] [ 3.2873388e-10 4.495451e-10 4.2732981e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -7e-07 1.35e-05 -5.6e-06 ] [ 7.1e-06 5.1e-06 -5.4e-06 ] [ -1.26e-05 -6.6e-06 4e-07 ] [ -7e-07 -2.1e-06 -9e-07 ] [ -9e-07 -5.7e-06 1.36e-05 ] [ -2e-07 7.7e-06 4.6e-06 ] [ 8.1e-06 -1.2e-05 -6.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.12152363456e-15 2.16293843808e-14 -8.972189076479999e-15 ] [ 1.137545400768e-14 8.17110076608e-15 -8.65175375232e-15 ] [ -2.018742542208e-14 -1.057436569728e-14 6.408706483200001e-16 ] [ -1.12152363456e-15 -3.36457090368e-15 -1.44195895872e-15 ] [ -1.44195895872e-15 -9.13240673856e-15 2.178960204288e-14 ] [ -3.2043532416e-16 1.233675998016e-14 7.370012455680001e-15 ] [ 1.297763062848e-14 -1.92261194496e-14 -1.073458335936e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.403283 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.307660328536609e-18 } }