{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 6.663861e-11 1.2140011e-10 -4.4379155e-10 ] [ -2.7844533e-10 4.6789e-13 4.869561100000001e-10 ] [ 8.2769295e-10 -7.821343e-11 1.734219e-10 ] [ 4.9715588e-10 3.3707112e-10 1.02094082e-09 ] [ 3.273059e-10 8.6145021e-10 1.8347039e-10 ] ] "source-value" [ [ 0.6663861 1.2140011 -4.4379155 ] [ -2.7844533 0.0046789 4.8695611 ] [ 8.2769295 -0.7821343 1.734219 ] [ 4.9715588 3.3707112 10.2094082 ] [ 3.273059 8.6145021 1.8347039 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 3.2043532416e-16 1.6021766208e-16 -6.408706483200001e-16 ] [ -9.6130597248e-16 -3.2043532416e-16 3.2043532416e-16 ] [ 0.0 0.0 0.0 ] [ 6.408706483200001e-16 3.2043532416e-16 4.8065298624e-16 ] [ 0.0 0.0 0.0 ] ] "source-value" [ [ 2e-07 1e-07 -4e-07 ] [ -6e-07 -2e-07 2e-07 ] [ 0.0 0.0 0.0 ] [ 4e-07 2e-07 3e-07 ] [ 0.0 0.0 0.0 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 5.114329139987075e-31 "source-value" 3.1921132e-12 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -7.897744600833898e-09 -5.06654614488366e-09 -2.370630916590404e-08 ] [ -2.535372772968687e-08 -1.062116783985616e-08 7.632621540589099e-09 ] [ 2.374482821556833e-08 -1.385612489796071e-08 -5.541249608459981e-09 ] [ 7.758861362418808e-09 2.408895300280815e-09 2.614436215807147e-08 ] [ 1.747782752533628e-09 2.713494342220205e-08 -4.529425084514212e-09 ] ] "source-value" [ [ -4.9293845 -3.1622894 -14.7963145 ] [ -15.8245523 -6.6292116 4.7639077 ] [ 14.8203562 -8.648313 -3.458576 ] [ 4.8427004 1.5035142 16.3180275 ] [ 1.0908802 16.9362997 -2.8270448 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 1.33036118870129e-17 "source-value" 83.034615 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.38521e-10 1.90546e-10 8.111876000000001e-11 ] [ 1.820048e-10 1.934055e-10 3.373724e-10 ] [ 3.762919e-10 1.896883e-10 2.504871e-10 ] [ 3.3319e-10 2.668439e-10 4.803022000000001e-10 ] [ 3.103403e-10 4.016922e-10 2.717172e-10 ] ] "source-value" [ [ 2.38521 1.90546 0.8111876 ] [ 1.820048 1.934055 3.373724 ] [ 3.762919 1.896883 2.504871 ] [ 3.3319 2.668439 4.803022 ] [ 3.103403 4.016922 2.717172 ] ] } "instance-id" 1 }