{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.0655506e-10 1.695749e-10 2.7147942e-10 ] [ 3.1003904e-10 2.0515959e-10 4.833336300000001e-10 ] [ 1.4017368e-10 3.902822700000001e-10 2.5422483e-10 ] [ 4.2323302e-10 2.1583809e-10 1.8332975e-10 ] [ 5.101482500000001e-10 1.4666099e-10 3.8521817e-10 ] [ 3.7663522e-10 4.4031485e-10 2.139615e-10 ] [ 2.9056573e-10 4.3216351e-10 4.431534e-10 ] ] "source-value" [ [ 2.0655506 1.695749 2.7147942 ] [ 3.1003904 2.0515959 4.8333363 ] [ 1.4017368 3.9028227 2.5422483 ] [ 4.2323302 2.1583809 1.8332975 ] [ 5.1014825 1.4666099 3.8521817 ] [ 3.7663522 4.4031485 2.139615 ] [ 2.9056573 4.3216351 4.431534 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -3.63309570532608e-12 -1.99342815159936e-12 1.8072552282624e-13 ] [ 4.84354014234048e-12 5.13705889927104e-12 -9.185278567046402e-12 ] [ 1.93126369871232e-12 -1.21076487233856e-12 -3.7058345239104e-13 ] [ 2.64359142432e-14 -7.97531478301824e-12 5.15083761820992e-12 ] [ 5.0772977113152e-13 -1.37578906428096e-12 -1.89889973097216e-12 ] [ 3.7378780563264e-13 6.2348703198432e-12 2.36369116866624e-12 ] [ -4.04934119140992e-12 1.18336765212288e-12 3.75934722304512e-12 ] ] "source-value" [ [ -0.0022676 -0.0012442 0.0001128 ] [ 0.0030231 0.0032063 -0.005733 ] [ 0.0012054 -0.0007557 -0.0002313 ] [ 1.65e-05 -0.0049778 0.0032149 ] [ 0.0003169 -0.0008587 -0.0011852 ] [ 0.0002333 0.0038915 0.0014753 ] [ -0.0025274 0.0007386 0.0023464 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -3.611599141387145e-18 "source-value" -22.541829 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -5.683039035047539e-10 -5.180219935258771e-10 -1.989932362430436e-09 ] [ -6.661421005952027e-10 -2.925240615973025e-09 6.14357397011314e-09 ] [ -4.462296447585285e-09 5.625202061213281e-10 -3.363232605548646e-09 ] [ -9.632779314648807e-10 1.861073943131693e-09 -6.652560969239002e-09 ] [ 1.582730041847378e-09 -1.063566497479181e-10 3.478640591898111e-09 ] [ 1.600862034882633e-09 -1.054232376704062e-09 -5.392668555176851e-10 ] [ 3.476428146202448e-09 2.1802573264802e-09 2.922778070506856e-09 ] ] "source-value" [ [ -0.3547074 -0.3233239 -1.2420181 ] [ -0.4157732 -1.8257916 3.8345173 ] [ -2.7851464 0.3510975 -2.0991647 ] [ -0.6012308 1.161591 -4.152202 ] [ 0.9878624 -0.0663826 2.1711967 ] [ 0.9991795 -0.6580001 -0.3365839 ] [ 2.1698158 1.3608096 1.8242546 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -3.334513749838468e-18 "source-value" -20.812398 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.999551e-10 1.685791e-10 2.486539e-10 ] [ 2.806467e-10 1.943327e-10 4.558328e-10 ] [ 1.52714e-10 3.922099e-10 3.002179e-10 ] [ 4.336396e-10 2.072479e-10 2.061694e-10 ] [ 5.046676e-10 1.88237e-10 4.081611e-10 ] [ 3.556935e-10 4.352885e-10 1.849563e-10 ] [ 3.300335e-10 4.140991e-10 4.307093e-10 ] ] "source-value" [ [ 1.999551 1.685791 2.486539 ] [ 2.806467 1.943327 4.558328 ] [ 1.52714 3.922099 3.002179 ] [ 4.336396 2.072479 2.061694 ] [ 5.046676 1.88237 4.081611 ] [ 3.556935 4.352885 1.849563 ] [ 3.300335 4.140991 4.307093 ] ] } "instance-id" 1 }