{ "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" [ [ 2.221555 1.50122 1.826509 ] [ 1.576881 2.934657 3.026633 ] [ 2.584327 1.716088 4.47164 ] [ 2.903501 3.607036 1.073051 ] [ 4.2877 3.061946 5.191695 ] [ 4.423391 1.863673 3.155042 ] [ 3.612063 4.220863 3.087476 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.221555e-10 1.50122e-10 1.826509e-10 ] [ 1.576881e-10 2.934657e-10 3.026633e-10 ] [ 2.584327e-10 1.716088e-10 4.47164e-10 ] [ 2.903501e-10 3.607036e-10 1.073051e-10 ] [ 4.2877e-10 3.061946e-10 5.191695e-10 ] [ 4.423391e-10 1.863673e-10 3.155042e-10 ] [ 3.612063e-10 4.220863e-10 3.087476e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.8908736 1.2462023 -0.7671242 ] [ -8.5402166 -4.4348419 3.385408 ] [ -5.2639811 -3.9457284 5.7084319 ] [ 3.2441646 1.5258866 -10.2926392 ] [ 2.4986868 3.1837924 5.525316 ] [ 6.7876097 -4.9211552 -5.5921806 ] [ 3.1646101 7.3458442 2.032788 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.029513474807931e-09 1.996636189847188e-09 -1.229068458489903e-09 ] [ -1.368293537308807e-08 -7.105400009124252e-09 5.424021549469286e-09 ] [ -8.433827450753065e-09 -6.321753794506591e-09 9.145916131608923e-09 ] [ 5.197724676146984e-09 2.444739836512001e-09 -1.649062589256962e-08 ] [ 4.003337573661566e-09 5.100997748760722e-09 8.852532117732173e-09 ] [ 1.08749495724553e-08 -7.884559808768349e-09 -8.959661016611317e-09 ] [ 5.07026431616755e-09 1.176933983727928e-08 3.256885408642791e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.0123624 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.443939633545698e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.2441438 1.7373788 1.382148 ] [ 1.2460489 2.7756446 3.4637339 ] [ 2.8975255 1.5230347 4.9165882 ] [ 3.6584549 3.8321609 0.8757887 ] [ 4.4443311 3.5743518 5.1269937 ] [ 4.0528154 1.0703735 2.8414577 ] [ 3.0660984 4.3925389 3.2253359 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2441438e-10 1.7373788e-10 1.382148e-10 ] [ 1.2460489e-10 2.7756446e-10 3.4637339e-10 ] [ 2.8975255e-10 1.5230347e-10 4.9165882e-10 ] [ 3.658454900000001e-10 3.8321609e-10 8.757887e-11 ] [ 4.4443311e-10 3.5743518e-10 5.1269937e-10 ] [ 4.0528154e-10 1.0703735e-10 2.8414577e-10 ] [ 3.0660984e-10 4.3925389e-10 3.2253359e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.77e-05 5.4e-06 1.03e-05 ] [ 2.26e-05 2.24e-05 -3.8e-06 ] [ 2e-06 -9e-07 7.2e-06 ] [ -2.87e-05 4e-06 1.3e-06 ] [ -1.23e-05 -9.8e-06 2.24e-05 ] [ -1e-06 -3.8e-06 -8.4e-06 ] [ -4e-07 -1.75e-05 -2.89e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.835852618816e-14 8.65175375232e-15 1.650241919424e-14 ] [ 3.620919163008e-14 3.588875630592e-14 -6.08827115904e-15 ] [ 3.2043532416e-15 -1.44195895872e-15 1.153567166976e-14 ] [ -4.598246901696e-14 6.4087064832e-15 2.08282960704e-15 ] [ -1.970677243584e-14 -1.570133088384e-14 3.588875630592e-14 ] [ -1.6021766208e-15 -6.08827115904e-15 -1.345828361472e-14 ] [ -6.408706483200001e-16 -2.8038090864e-14 -4.630290434112001e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.530913 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.968979557067879e-18 } }