{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 3.044824 1.955008 1.363184 ] [ 4.804837 1.704442 0.3842414 ] [ 5.395877 3.200403 2.033527 ] [ 3.92549 3.943599 0.3069547 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.044824e-10 1.955008e-10 1.363184e-10 ] [ 4.804837e-10 1.704442e-10 3.842414e-11 ] [ 5.395877e-10 3.200403e-10 2.033527e-10 ] [ 3.92549e-10 3.943599e-10 3.069547e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.9665506 1.3607409 1.4490655 ] [ 5.353649 1.2637078 0.8685289 ] [ -4.4863434 -0.4614164 -7.4874254 ] [ 3.099245 -2.1630324 5.169831 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.355114636540213e-09 2.180147256946351e-09 2.321658866107863e-09 ] [ 8.577491263769298e-09 2.024683092682602e-09 1.391536698069141e-09 ] [ -7.187914508360383e-09 -7.392705685337011e-10 -1.199617792586409e-08 ] [ 4.965537881131295e-09 -3.465559941312914e-09 8.282982361687087e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -4.2588754 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.823470596780249e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.7194144 0.0453894 1.0543414 ] [ 4.3789214 1.4930152 1.1403866 ] [ 5.1688527 3.5455302 1.0599628 ] [ 4.9038395 5.7195172 0.8332163 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.7194144e-10 4.538940000000001e-12 1.0543414e-10 ] [ 4.3789214e-10 1.4930152e-10 1.1403866e-10 ] [ 5.168852700000001e-10 3.5455302e-10 1.0599628e-10 ] [ 4.9038395e-10 5.719517200000001e-10 8.332163e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.4467342 0.3101258 0.030247 ] [ -0.4814389 -0.4007775 -0.0267366 ] [ -0.049732 0.2836215 -0.0314642 ] [ 0.0844367 -0.1929698 0.0279538 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.157470909517914e-10 4.968763062668967e-10 4.84610362493376e-11 ] [ -7.713501499236691e-10 -6.421163406426721e-10 -4.283675543968128e-11 ] [ -7.967944770562561e-11 4.544117364562273e-10 -5.041120563217536e-11 ] [ 1.352825066775034e-10 -3.091717020804519e-10 4.478692482251905e-11 ] ] } "relaxed-potential-energy" { "source-value" -8.3828916 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.343087293622071e-18 } }