{ "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" [ [ 2.719922 0.6324479 2.001085 ] [ 1.570016 2.535953 2.950979 ] [ 1.512501 2.471908 5.050939 ] [ 3.556391 2.380181 1.668166 ] [ 3.168972 1.023761 5.396195 ] [ 4.64835 1.331065 3.67677 ] [ 3.603196 3.529371 4.833641 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.719922e-10 6.324478999999999e-11 2.001085e-10 ] [ 1.570016e-10 2.535953e-10 2.950979e-10 ] [ 1.512501e-10 2.471908e-10 5.050939e-10 ] [ 3.556391e-10 2.380181e-10 1.668166e-10 ] [ 3.168972e-10 1.023761e-10 5.396195e-10 ] [ 4.64835e-10 1.331065e-10 3.67677e-10 ] [ 3.603196e-10 3.529371e-10 4.833641e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -58.1996603 -132.8377368 22.4389789 ] [ -7.7455884 6.7991833 -47.9915207 ] [ -14.8281285 6.19651 47.9031349 ] [ 65.0428541 127.4267621 -25.1460582 ] [ 1.7793274 -15.3853245 13.9237282 ] [ 8.0912506 3.5527693 -10.3074071 ] [ 5.8599452 4.2478366 -0.820856 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.324613583939742e-08 -2.128295180144019e-07 3.595120768439901e-08 ] [ -1.240980075106144e-08 1.089349261354301e-08 -7.689089309566732e-08 ] [ -2.375728100864947e-08 9.927903534347339e-09 7.674928343212991e-08 ] [ 1.042101410476911e-07 2.041601807828968e-07 -4.028842688524409e-08 ] [ 2.850796784515971e-09 -2.465000742040773e-08 2.230827198020688e-08 ] [ 1.296361265115848e-08 5.692163958452535e-09 -1.65142868127457e-08 ] [ 9.388667275960458e-09 6.805784545570004e-09 -1.315156303078704e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 11.628205 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.863043834636197e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.7337148 0.2883142 2.1125516 ] [ 1.177639 2.3506793 2.5214761 ] [ 1.4799441 2.7490774 5.0048052 ] [ 3.5766004 2.8400022 1.6008729 ] [ 3.1648189 0.8564844 5.6538222 ] [ 4.6390415 1.4120571 3.5427573 ] [ 4.0075892 3.4080724 5.1414896 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.7337148e-10 2.883142e-11 2.1125516e-10 ] [ 1.177639e-10 2.3506793e-10 2.5214761e-10 ] [ 1.4799441e-10 2.7490774e-10 5.0048052e-10 ] [ 3.5766004e-10 2.8400022e-10 1.6008729e-10 ] [ 3.1648189e-10 8.564844e-11 5.653822199999999e-10 ] [ 4.639041500000001e-10 1.4120571e-10 3.5427573e-10 ] [ 4.0075892e-10 3.4080724e-10 5.1414896e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.8e-05 1.62e-05 3.6e-06 ] [ 5.04e-05 -9.1e-06 4e-06 ] [ -2.77e-05 1.93e-05 -1.4e-06 ] [ -3.88e-05 -4.33e-05 -2.94e-05 ] [ -6e-07 -3.48e-05 -3.91e-05 ] [ -1.2e-06 6.78e-05 5.13e-05 ] [ 3.61e-05 -1.59e-05 1.1e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.8839179412e-14 2.59552614708e-14 5.767835882399999e-15 ] [ 8.074970235359998e-14 -1.45798073694e-14 6.408706535999999e-15 ] [ -4.438029276179999e-14 3.09220090362e-14 -2.2430472876e-15 ] [ -6.21644533992e-14 -6.93742482522e-14 -4.710399303959999e-14 ] [ -9.613059803999998e-16 -5.575574686319999e-14 -6.26451063894e-14 ] [ -1.9226119608e-15 1.086275757852e-13 8.21916613242e-14 ] [ 5.783857648740001e-14 -2.54746084806e-14 1.7623942974e-14 ] ] } "relaxed-potential-energy" { "source-value" -24.072753 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.85688023726534e-18 } }