{ "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" [ [ 2.845445 0.9973996 1.833851 ] [ 2.258239 2.496991 3.58031 ] [ 1.78294 4.270758 1.69672 ] [ 2.678494 4.477221 3.72616 ] [ 4.64173 2.41566 3.489752 ] [ 3.528967 5.47506 1.628646 ] [ 3.443776 3.131475 0.8054665 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.845445e-10 9.973996000000001e-11 1.833851e-10 ] [ 2.258239e-10 2.496991e-10 3.58031e-10 ] [ 1.78294e-10 4.270758e-10 1.69672e-10 ] [ 2.678494e-10 4.477221e-10 3.72616e-10 ] [ 4.64173e-10 2.41566e-10 3.489752e-10 ] [ 3.528967e-10 5.475060000000001e-10 1.628646e-10 ] [ 3.443776e-10 3.131475e-10 8.054665e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 3.6528742 1.7032194 1.9005087 ] [ -2.1925213 -4.0480771 2.0235054 ] [ -13.2819655 -1.6015995 -4.8119915 ] [ 7.5487705 -6.7075744 14.3917173 ] [ -9.5259274 5.0876905 -1.9606024 ] [ 10.1443301 18.1623294 -5.0524468 ] [ 3.6544394 -12.5959883 -6.4906906 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.852549690181442e-09 2.728858325255499e-09 3.044950631853716e-09 ] [ -3.512806396407304e-09 -6.485734542250481e-09 3.242013070652823e-09 ] [ -2.128005477769413e-08 -2.566045295926083e-09 -7.709660344306611e-09 ] [ 1.20944637105285e-08 -1.074671897449657e-08 2.305807318119357e-08 ] [ -1.526221829746037e-08 8.151378840123777e-09 -3.141231353844321e-09 ] [ 1.625300865380288e-08 2.909925978369124e-08 -8.094912207488072e-09 ] [ 5.855057417048978e-09 -2.018099813639738e-08 -1.039923281784344e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -15.76583 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.525964444161622e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.8878048 1.024123 1.8324014 ] [ 1.8933578 2.3502698 3.6939372 ] [ 1.6322189 3.9574122 1.8157041 ] [ 2.9607332 4.6306567 3.879452 ] [ 4.349968 2.7089323 3.133866 ] [ 3.7217489 5.4671703 1.6581957 ] [ 3.7337593 3.1260002 0.747349 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.8878048e-10 1.024123e-10 1.8324014e-10 ] [ 1.8933578e-10 2.3502698e-10 3.6939372e-10 ] [ 1.6322189e-10 3.9574122e-10 1.8157041e-10 ] [ 2.9607332e-10 4.6306567e-10 3.879452e-10 ] [ 4.349968e-10 2.7089323e-10 3.133866e-10 ] [ 3.7217489e-10 5.467170300000001e-10 1.6581957e-10 ] [ 3.7337593e-10 3.1260002e-10 7.473490000000001e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.37e-05 -1.86e-05 1.64e-05 ] [ -8.38e-05 -7.34e-05 2.3e-06 ] [ -8.46e-05 -4.45e-05 3.9e-06 ] [ 7.05e-05 -1.27e-05 4.43e-05 ] [ 1.81e-05 5.84e-05 2.87e-05 ] [ 6.23e-05 0.0001213 -4.1e-05 ] [ 4.12e-05 -3.04e-05 -5.46e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.79715862258e-14 -2.98004853924e-14 2.62756967976e-14 ] [ -1.342624019292e-13 -1.175997649356e-13 3.685006258199999e-15 ] [ -1.355441432364e-13 -7.129686021299999e-14 6.248488872599999e-15 ] [ 1.12953452697e-13 -2.03476432518e-14 7.09764248862e-14 ] [ 2.899939707539999e-14 9.35671154256e-14 4.598246939579999e-14 ] [ 9.981560429819998e-14 1.943440257042e-13 -6.568924199399999e-14 ] [ 6.600967732079998e-14 -4.870616967359999e-14 -8.74788442164e-14 ] ] } "relaxed-potential-energy" { "source-value" -26.335586 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.219426053189752e-18 } }