{ "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" [ [ 2.290406 1.365127 2.478138 ] [ 1.892594 2.812526 4.141756 ] [ 2.634032 3.625436 1.937955 ] [ 4.696761 2.293416 2.137678 ] [ 4.185297 2.165547 4.431715 ] [ 4.453239 5.273552 2.545611 ] [ 3.870361 4.380343 4.592008 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.290406e-10 1.365127e-10 2.478138e-10 ] [ 1.892594e-10 2.812526e-10 4.141756e-10 ] [ 2.634032e-10 3.625436e-10 1.937955e-10 ] [ 4.696761000000001e-10 2.293416e-10 2.137678e-10 ] [ 4.185297000000001e-10 2.165547e-10 4.431715e-10 ] [ 4.453239e-10 5.273551999999999e-10 2.545611e-10 ] [ 3.870361e-10 4.380343e-10 4.592008e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.0483788 -7.4393403 -3.8355788 ] [ -9.333682 0.8257192 6.5028858 ] [ -3.9133196 6.2707725 -6.046383 ] [ 6.4921415 -1.5570127 -3.832765 ] [ 5.2004453 -6.0285042 5.875161 ] [ 1.4639995 1.4109512 -0.3461684 ] [ 2.1387941 6.5174142 1.6828485 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.281864623902359e-09 -1.191913710283526e-08 -6.145274680596118e-09 ] [ -1.495420708638179e-08 1.322947997585679e-09 1.04187715964923e-08 ] [ -6.269829172838407e-09 1.004688509385557e-08 -9.687373483002566e-09 ] [ 1.040155733022544e-08 -2.494609346228684e-09 -6.140766476020512e-09 ] [ 8.332031877409243e-09 -9.658728487634608e-09 9.413045597635949e-09 ] [ 2.345585771762889e-09 2.260593025729705e-09 -5.546229173397427e-10 ] [ 3.426725903724978e-09 1.044204865930994e-08 2.696220523048349e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 2.9178387 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.674892948405465e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.2005787 1.2491155 2.458702 ] [ 1.5720146 2.7580495 4.2416017 ] [ 2.4242484 3.8090555 1.7195052 ] [ 4.9133645 2.2226128 2.1803526 ] [ 4.4198331 2.0709154 4.4747402 ] [ 4.524607 5.3054842 2.5749378 ] [ 3.9680436 4.5007141 4.6150216 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2005787e-10 1.2491155e-10 2.458702e-10 ] [ 1.5720146e-10 2.7580495e-10 4.2416017e-10 ] [ 2.4242484e-10 3.8090555e-10 1.7195052e-10 ] [ 4.9133645e-10 2.2226128e-10 2.1803526e-10 ] [ 4.4198331e-10 2.0709154e-10 4.4747402e-10 ] [ 4.524607e-10 5.305484200000001e-10 2.5749378e-10 ] [ 3.968043600000001e-10 4.5007141e-10 4.615021600000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.421769 0.9364325 1.2407645 ] [ -1.1807742 -1.8347474 -0.846022 ] [ -1.5922228 -0.2167517 -1.7767485 ] [ 1.0617016 0.171744 2.7257693 ] [ 2.2956002 1.6697743 -2.1031181 ] [ 1.1998451 0.0185445 1.2847619 ] [ 0.637619 -0.7449962 -0.5254071 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.880101672778195e-09 1.500330258457296e-09 1.987923873818602e-09 ] [ -1.891808817683824e-09 -2.939589389353586e-09 -1.355476669082458e-09 ] [ -2.551022145264714e-09 -3.472745062586554e-10 -2.846664907741469e-09 ] [ 1.701033481785953e-09 2.751642215626752e-10 4.367163846154382e-09 ] [ 3.677956971143804e-09 2.675273345472686e-09 -3.369566650601317e-09 ] [ 1.922363767801438e-09 2.97115643444256e-11 2.058415479474587e-09 ] [ 1.021578254777875e-09 -1.193615494224841e-09 -8.417949720223277e-10 ] ] } "relaxed-potential-energy" { "source-value" -13.992524 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.24184948187829e-18 } }