{ "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" [ [ 1.891577 1.147444 4.176951 ] [ 1.947528 5.315412 2.001915 ] [ 3.037668 3.274696 0.9821769 ] [ 1.344392 3.383525 2.90788 ] [ 3.679276 1.837825 2.704146 ] [ 4.016034 4.351153 3.141989 ] [ 3.129852 3.103182 4.716137 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.891577e-10 1.147444e-10 4.176951e-10 ] [ 1.947528e-10 5.315412000000001e-10 2.001915e-10 ] [ 3.037668e-10 3.274696e-10 9.821769000000001e-11 ] [ 1.344392e-10 3.383525e-10 2.90788e-10 ] [ 3.679276000000001e-10 1.837825e-10 2.704146e-10 ] [ 4.016034e-10 4.351153e-10 3.141989e-10 ] [ 3.129852e-10 3.103182e-10 4.716137e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.0012957 -2.0138677 0.461207 ] [ 0.7265522 4.2593266 -1.660036 ] [ -0.0644213 0.7522676 -3.048137 ] [ -9.8413717 -3.4819538 1.5805937 ] [ 4.7115944 -4.5999792 -1.0437787 ] [ 7.2118432 5.3167438 -2.218389 ] [ -0.7429011 -0.2325373 5.9285399 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.206429208264674e-09 -3.226571772907321e-09 7.389350788372379e-10 ] [ 1.164064958221295e-09 6.824193555094663e-09 -2.659670890798824e-09 ] [ -1.032143015919042e-10 1.205265571235258e-09 -4.883653878630857e-09 ] [ -1.576761578424886e-08 -5.578705019027508e-09 2.532390293987606e-09 ] [ 7.548806456565249e-09 -7.369979191126012e-09 -1.672317844206896e-09 ] [ 1.155464666311179e-08 8.518362685324369e-09 -3.554251020922626e-09 ] [ -1.190258783792897e-09 -3.725658285934481e-10 9.498568101516694e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -13.353952 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.139538986595757e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.8519237 1.0690398 3.9029657 ] [ 2.090532 5.4464066 2.0628652 ] [ 2.7958367 3.1505144 1.0840718 ] [ 1.0312888 3.3277262 3.0275623 ] [ 4.0484202 1.771296 2.8291126 ] [ 4.2504379 4.4197092 2.929824 ] [ 2.9778877 3.2285448 4.7947933 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.8519237e-10 1.0690398e-10 3.9029657e-10 ] [ 2.090532e-10 5.4464066e-10 2.0628652e-10 ] [ 2.7958367e-10 3.1505144e-10 1.0840718e-10 ] [ 1.0312888e-10 3.3277262e-10 3.0275623e-10 ] [ 4.0484202e-10 1.771296e-10 2.8291126e-10 ] [ 4.2504379e-10 4.4197092e-10 2.929824e-10 ] [ 2.9778877e-10 3.2285448e-10 4.7947933e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.12e-05 1.62e-05 4.1e-06 ] [ 4.3e-06 -2.27e-05 1.3e-06 ] [ -1.77e-05 2.9e-06 1.02e-05 ] [ 4.06e-05 -3e-07 -4.3e-06 ] [ -8.9e-06 1.1e-05 -1.93e-05 ] [ -1.2e-06 -8.9e-06 9.1e-06 ] [ -2.84e-05 1.7e-06 -1.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.79443783008e-14 2.59552614708e-14 6.568924199399999e-15 ] [ 6.8893595262e-15 -3.636940959179999e-14 2.0828296242e-15 ] [ -2.83585264218e-14 4.6463122386e-15 1.63422016668e-14 ] [ 6.504837134039999e-14 -4.806529901999999e-16 -6.8893595262e-15 ] [ -1.42593720426e-14 1.7623942974e-14 -3.09220090362e-14 ] [ -1.9226119608e-15 -1.42593720426e-14 1.45798073694e-14 ] [ -4.550181640559999e-14 2.7237002778e-15 -1.7623942974e-15 ] ] } "relaxed-potential-energy" { "source-value" -16.515581 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.646087797513435e-18 } }