{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0140975 0.5833675 2.011711 ] [ 0.3860738 2.863563 1.325373 ] [ 1.128451 1.622429 0.5509609 ] [ 2.086312 0.6042059 2.517228 ] [ 2.318087 2.883056 0.8671461 ] [ 2.902063 1.818717 2.74846 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.40975e-12 5.833675e-11 2.011711e-10 ] [ 3.860738e-11 2.863563e-10 1.325373e-10 ] [ 1.128451e-10 1.622429e-10 5.509609e-11 ] [ 2.086312e-10 6.042059e-11 2.517228e-10 ] [ 2.318087e-10 2.883056e-10 8.671461e-11 ] [ 2.902063e-10 1.818717e-10 2.74846e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.6470945 -3.434368 3.5811243 ] [ -28.8153801 32.3827536 20.2018318 ] [ 3.5932038 -45.642109 -29.2460296 ] [ -36.3204247 -62.6433838 -9.1569839 ] [ 26.2624623 18.8949612 2.0081198 ] [ 41.9272332 60.442146 12.6119376 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.064981940414827e-08 -5.502464116823655e-09 5.737593629638765e-09 ] [ -4.616732831568556e-08 5.188289073504703e-08 3.236690260729399e-08 ] [ 5.75694712212972e-09 -7.312671996380527e-08 -4.685730487634477e-08 ] [ -5.819173531186684e-08 -1.003657649721615e-07 -1.467110552162201e-08 ] [ 4.207710310170139e-08 3.027306508556311e-08 3.217362595325571e-09 ] [ 6.717483280786958e-08 9.683899323218024e-08 2.020655156570846e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 18.585034 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.977650697157311e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.2587478 0.8278591 2.17825 ] [ -0.0266405 3.0052823 1.2319313 ] [ 1.3485189 1.1506176 0.3084333 ] [ 2.026307 0.1653235 2.4082522 ] [ 2.3505782 3.2074602 1.0860933 ] [ 3.3950685 2.0187956 2.8079189 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -2.587478e-11 8.278591e-11 2.17825e-10 ] [ -2.66405e-12 3.0052823e-10 1.2319313e-10 ] [ 1.3485189e-10 1.1506176e-10 3.084333e-11 ] [ 2.026307e-10 1.653235e-11 2.4082522e-10 ] [ 2.3505782e-10 3.2074602e-10 1.0860933e-10 ] [ 3.3950685e-10 2.0187956e-10 2.8079189e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.29e-05 1.3e-06 1.5e-05 ] [ -5.8e-06 3.8e-06 -2.8e-06 ] [ 4.99e-05 4.74e-05 6.6e-06 ] [ 1.01e-05 -1.4e-06 1.73e-05 ] [ -4.46e-05 -7.1e-06 -4.55e-05 ] [ 3.1e-06 -4.4e-05 9.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.066807840832e-14 2.08282960704e-15 2.4032649312e-14 ] [ -9.292624400640001e-15 6.08827115904e-15 -4.48609453824e-15 ] [ 7.994861337792e-14 7.594317182591999e-14 1.057436569728e-14 ] [ 1.618198387008e-14 -2.24304726912e-15 2.771765553984e-14 ] [ -7.145707728768e-14 -1.137545400768e-14 -7.28990362464e-14 ] [ 4.96674752448e-15 -7.04957713152e-14 1.506046023552e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.859021 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.861330591657623e-18 } }