{ "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" [ [ 2.04098 2.133134 3.812884 ] [ 2.161605 4.797503 2.926814 ] [ 2.748178 3.149118 1.513672 ] [ 4.833213 2.247647 2.725743 ] [ 4.087134 1.710162 4.852625 ] [ 4.720686 4.556589 2.507622 ] [ 3.429181 3.830938 4.469304 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.04098e-10 2.133134e-10 3.812884e-10 ] [ 2.161605e-10 4.797503e-10 2.926814e-10 ] [ 2.748178e-10 3.149118e-10 1.513672e-10 ] [ 4.833213e-10 2.247647e-10 2.725743e-10 ] [ 4.087134e-10 1.710162e-10 4.852625e-10 ] [ 4.720686e-10 4.556589e-10 2.507622e-10 ] [ 3.429181e-10 3.830938e-10 4.469304000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -9.0006117 -4.7631319 -3.3284252 ] [ -5.3077644 6.8233086 -0.7499569 ] [ 0.5718783 -5.6324421 -6.1221803 ] [ 3.4163841 -4.0907816 -3.5979173 ] [ 3.931468 -6.0998633 3.46221 ] [ 1.3351364 3.8259136 -1.2624292 ] [ 5.0535093 9.9369967 11.5986989 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.442056963863895e-08 -7.631378571966684e-09 -5.332725039521564e-09 ] [ -8.50397603039454e-09 1.093214551542358e-08 -1.201563411787644e-09 ] [ 9.162500422028486e-10 -9.024167050629655e-09 -9.80881414498233e-09 ] [ 5.473650732692849e-09 -6.554154640318816e-09 -5.76449898163186e-09 ] [ 6.298906115023335e-09 -9.773058369335936e-09 5.547071918299968e-09 ] [ 2.139124325659077e-09 6.129789323120763e-09 -2.022634549655247e-09 ] [ 8.096614453455373e-09 1.592082379370675e-08 1.858316420927868e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -14.782598 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.368433291028484e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.723381 2.0908052 3.4804444 ] [ 2.0402838 4.5909754 3.2118388 ] [ 2.9168008 2.8817327 1.389123 ] [ 5.0191186 2.1024569 2.5708199 ] [ 3.8411085 1.8497694 4.7248571 ] [ 4.5928885 4.6000003 2.5073569 ] [ 3.8873958 4.3093511 4.9242239 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.723381e-10 2.0908052e-10 3.4804444e-10 ] [ 2.0402838e-10 4.5909754e-10 3.2118388e-10 ] [ 2.9168008e-10 2.8817327e-10 1.389123e-10 ] [ 5.0191186e-10 2.1024569e-10 2.5708199e-10 ] [ 3.8411085e-10 1.8497694e-10 4.7248571e-10 ] [ 4.5928885e-10 4.6000003e-10 2.5073569e-10 ] [ 3.8873958e-10 4.3093511e-10 4.9242239e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.43e-05 -1.84e-05 -1.16e-05 ] [ -1.86e-05 3.11e-05 1.9e-06 ] [ 1.49e-05 -2.51e-05 2.8e-06 ] [ 2.1e-06 8.4e-06 3.02e-05 ] [ -1.12e-05 1.45e-05 -2.61e-05 ] [ -2.84e-05 6.2e-06 1.61e-05 ] [ 5.55e-05 -1.66e-05 -1.31e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.291112567744e-14 -2.948004982272e-14 -1.858524880128e-14 ] [ -2.980048514688e-14 4.982769290688e-14 3.04413557952e-15 ] [ 2.387243164992e-14 -4.021463318208e-14 4.48609453824e-15 ] [ 3.36457090368e-15 1.345828361472e-14 4.838573394816e-14 ] [ -1.794437815296e-14 2.32315610016e-14 -4.181680980288e-14 ] [ -4.550181603071999e-14 9.93349504896e-15 2.579504359488e-14 ] [ 8.892080245440001e-14 -2.659613190528e-14 -2.098851373248e-14 ] ] } "relaxed-potential-energy" { "source-value" -21.881227 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.505759033381772e-18 } }