{ "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" [ [ 2.887739 1.995765 3.859098 ] [ 2.327199 3.871069 1.984027 ] [ 1.151407 3.535975 3.566474 ] [ 2.937456 4.643275 4.143131 ] [ 3.294842 1.915913 1.493263 ] [ 5.055976 2.713207 3.11233 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.887739e-10 1.995765e-10 3.859098e-10 ] [ 2.327199e-10 3.871069e-10 1.984027e-10 ] [ 1.151407e-10 3.535975e-10 3.566474e-10 ] [ 2.937456e-10 4.643275e-10 4.143131e-10 ] [ 3.294842e-10 1.915913e-10 1.493263e-10 ] [ 5.055976000000001e-10 2.713207e-10 3.11233e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.7048741 -6.5499628 10.0722633 ] [ 49.5881295 27.7724775 -90.421643 ] [ -81.4894816 -29.9969343 72.7815222 ] [ 24.6334222 18.4935831 17.481953 ] [ 4.6794563 -12.4422211 -9.6029535 ] [ 8.2933478 2.7230577 -0.3111421 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.140215907627441e-09 -1.049419726526971e-08 1.613754477780186e-08 ] [ 7.94489417541028e-08 4.449641415219403e-08 -1.44871442428924e-07 ] [ -1.305605422606318e-07 -4.806038683113361e-08 1.166088532950762e-07 ] [ 3.94670931391357e-08 2.962998647764199e-08 2.800917638252442e-08 ] [ 7.497315481915271e-09 -1.993463575724446e-08 -1.538562758832953e-08 ] [ 1.328740795332311e-08 4.36281938402942e-09 -4.985045983666157e-10 ] ] } "unrelaxed-potential-energy" { "source-value" 5.1310491 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 8.220846908196882e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.7582044 1.760615 4.0314085 ] [ 2.0649142 4.1359924 1.5906278 ] [ 0.8039689 3.4914751 3.8012392 ] [ 3.3291085 4.5142123 3.8967172 ] [ 3.4993672 2.0102883 1.4921775 ] [ 5.1990559 2.7626209 3.3461527 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.7582044e-10 1.760615e-10 4.0314085e-10 ] [ 2.0649142e-10 4.1359924e-10 1.5906278e-10 ] [ 8.039689e-11 3.491475100000001e-10 3.8012392e-10 ] [ 3.3291085e-10 4.5142123e-10 3.8967172e-10 ] [ 3.4993672e-10 2.0102883e-10 1.4921775e-10 ] [ 5.1990559e-10 2.7626209e-10 3.346152700000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.63e-05 6.4e-06 -2.97e-05 ] [ -6.94e-05 4.95e-05 1.11e-05 ] [ 6.35e-05 2.1e-05 -2.14e-05 ] [ -3.82e-05 -1.83e-05 1.88e-05 ] [ 2.82e-05 -6.95e-05 2.18e-05 ] [ 4.24e-05 1.09e-05 -6e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.213724512704e-14 1.025393037312e-14 -4.758464563776e-14 ] [ -1.1119105748352e-13 7.930774272959999e-14 1.778416049088e-14 ] [ 1.017382154208e-13 3.36457090368e-14 -3.428657968511999e-14 ] [ -6.120314691456e-14 -2.931983216064e-14 3.012092047104e-14 ] [ 4.518138070656001e-14 -1.113512751456e-13 3.492745033344e-14 ] [ 6.793228872192001e-14 1.746372516672e-14 -9.6130597248e-16 ] ] } "relaxed-potential-energy" { "source-value" -20.70725 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.31766718310608e-18 } }