{ "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" [ [ 2.024908 1.18877 2.927879 ] [ 1.938594 2.418534 4.826435 ] [ 2.412467 3.694527 2.059811 ] [ 3.090256 4.25078 4.272664 ] [ 3.913894 1.726388 1.808826 ] [ 4.03064 2.069757 3.989682 ] [ 4.599294 3.851686 2.39416 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.024908e-10 1.18877e-10 2.927879e-10 ] [ 1.938594e-10 2.418534e-10 4.826435e-10 ] [ 2.412467e-10 3.694527e-10 2.059811e-10 ] [ 3.090256e-10 4.25078e-10 4.272664e-10 ] [ 3.913894e-10 1.726388e-10 1.808826e-10 ] [ 4.03064e-10 2.069757e-10 3.989682e-10 ] [ 4.599294e-10 3.851686e-10 2.39416e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -7.4322049 -8.6064384 -1.1230068 ] [ -7.001461 -0.9019797 4.9114962 ] [ -9.6220831 5.4336227 -5.3596266 ] [ 0.3331893 10.2722293 5.913477 ] [ 4.5855408 -7.2016276 -11.1241129 ] [ 9.1713875 -5.7568465 9.5813899 ] [ 9.9656314 6.7610401 -2.7996166 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.19077049317752e-08 -1.378903439283536e-08 -1.799255239959421e-09 ] [ -1.121757712564299e-08 -1.445130787776198e-09 7.86908438478804e-09 ] [ -1.541627658621479e-08 8.705623256188173e-09 -8.587068434737794e-09 ] [ 5.338281067607175e-10 1.645792562795675e-08 9.474434597038524e-09 ] [ 7.34684626348453e-09 -1.153827937242801e-08 -1.782279361551969e-08 ] [ 1.469418263279736e-08 -9.223484871834307e-09 1.535107889254925e-08 ] [ 1.596670164059037e-08 1.083238038051129e-08 -4.485480263723585e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 9.264349 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.484312337473186e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.6451969 1.2685584 3.1798352 ] [ 1.6108953 2.4696099 4.9884322 ] [ 2.5726284 4.1371101 1.5193103 ] [ 2.7627329 4.1577804 4.7337012 ] [ 4.1874512 1.1180488 1.8670462 ] [ 4.714814 1.7248251 3.8712267 ] [ 4.5163342 4.3245092 2.1199051 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.6451969e-10 1.2685584e-10 3.1798352e-10 ] [ 1.6108953e-10 2.4696099e-10 4.9884322e-10 ] [ 2.5726284e-10 4.1371101e-10 1.5193103e-10 ] [ 2.7627329e-10 4.1577804e-10 4.7337012e-10 ] [ 4.1874512e-10 1.1180488e-10 1.8670462e-10 ] [ 4.714813999999999e-10 1.7248251e-10 3.8712267e-10 ] [ 4.516334200000001e-10 4.3245092e-10 2.1199051e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.5541244 2.0469002 3.4073188 ] [ -0.6418395 -1.1379614 0.0309668 ] [ 0.9961284 0.1507104 -1.0430022 ] [ -0.7204786 -0.4190189 0.4362179 ] [ 4.7809735 0.0753602 -0.2137416 ] [ 0.8408046 -1.6176264 -1.7423156 ] [ -0.7014639 0.901636 -0.8754442 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.296511641894828e-09 3.279495645550844e-09 5.459126520972311e-09 ] [ -1.028340241205962e-09 -1.823215150452837e-09 4.961428298098945e-11 ] [ 1.595973633794911e-09 2.414646793914163e-10 -1.671073740282966e-09 ] [ -1.154333968706715e-09 -6.713422852533332e-10 6.988981209544723e-10 ] [ 7.659963966364349e-09 1.207403505788122e-10 -3.424517944123853e-10 ] [ 1.347117472781096e-09 -2.591723199268869e-09 -2.791497320375124e-09 ] [ -1.123869060915189e-09 1.444580119671629e-09 -1.402616230054959e-09 ] ] } "relaxed-potential-energy" { "source-value" -19.239678 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.08253622833201e-18 } }