{ "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" [ [ 1.173582 1.448006 2.849718 ] [ 1.983285 3.621531 1.348175 ] [ 2.327062 3.623818 3.682153 ] [ 3.341801 1.495458 1.660386 ] [ 3.963915 2.011825 3.715692 ] [ 4.47485 3.510245 1.32465 ] [ 4.551743 4.234559 4.054178 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.173582e-10 1.448006e-10 2.849718e-10 ] [ 1.983285e-10 3.621531e-10 1.348175e-10 ] [ 2.327062e-10 3.623818e-10 3.682153e-10 ] [ 3.341801e-10 1.495458e-10 1.660386e-10 ] [ 3.963915e-10 2.011825e-10 3.715692e-10 ] [ 4.47485e-10 3.510245e-10 1.32465e-10 ] [ 4.551743e-10 4.234559e-10 4.054178000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.0743516 -1.4427968 0.1131768 ] [ -1.2254699 2.4759359 -1.2648574 ] [ -4.6534707 3.1712656 2.1425413 ] [ 0.9280815 -4.5011897 -2.411684 ] [ 2.7693785 -4.3576231 3.47535 ] [ 1.9370544 2.5288677 -1.6192599 ] [ 2.3187778 2.1255403 -0.4352669 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.323477636839073e-09 -2.311615301525054e-09 1.813292229769574e-10 ] [ -1.963419223274114e-09 3.966886613579407e-09 -2.026524954925874e-09 ] [ -7.45568196111781e-09 5.080927602667285e-09 3.432729579958439e-09 ] [ 1.486950481496995e-09 -7.211700903125766e-09 -3.863943721557428e-09 ] [ 4.437033486846173e-09 -6.981681853078021e-09 5.568124519097281e-09 ] [ 3.103503272897772e-09 4.051692706036269e-09 -2.594340354778946e-09 ] [ 3.715091579990058e-09 3.405490975228218e-09 -6.973744509880916e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -10.286385 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.648060555954781e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.5237612 1.6416172 2.880041 ] [ 2.0720531 4.4558825 1.2948798 ] [ 1.8020194 3.8145615 3.4881227 ] [ 3.558048 1.2220923 1.9556079 ] [ 4.6137532 1.585974 3.9674735 ] [ 4.1176176 3.4033266 1.3226988 ] [ 4.1289855 3.8219878 3.7261284 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.5237612e-10 1.6416172e-10 2.880041e-10 ] [ 2.0720531e-10 4.455882500000001e-10 1.2948798e-10 ] [ 1.8020194e-10 3.8145615e-10 3.4881227e-10 ] [ 3.558048e-10 1.2220923e-10 1.9556079e-10 ] [ 4.6137532e-10 1.585974e-10 3.9674735e-10 ] [ 4.1176176e-10 3.4033266e-10 1.3226988e-10 ] [ 4.1289855e-10 3.8219878e-10 3.7261284e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.36e-05 -1.56e-05 -1.38e-05 ] [ -1.29e-05 -6.9e-06 -3.5e-06 ] [ 1.01e-05 1.85e-05 1.5e-05 ] [ -1.5e-05 1.82e-05 2.6e-06 ] [ -2.52e-05 2.02e-05 1e-06 ] [ 5.8e-06 -5.9e-06 1.51e-05 ] [ 3.6e-06 -2.85e-05 -1.64e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.383313445888e-14 -2.499395528448e-14 -2.211003736704e-14 ] [ -2.066807840832e-14 -1.105501868352e-14 -5.6076181728e-15 ] [ 1.618198387008e-14 2.96402674848e-14 2.4032649312e-14 ] [ -2.4032649312e-14 2.915961449856e-14 4.16565921408e-15 ] [ -4.037485084416e-14 3.236396774016e-14 1.6021766208e-15 ] [ 9.292624400640001e-15 -9.45284206272e-15 2.419286697408e-14 ] [ 5.76783583488e-15 -4.56620336928e-14 -2.627569658112e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.23956 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.281429012247885e-18 } }