{ "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" [ [ 1.032434 0.1172693 0.4247075 ] [ 0.2432392 0.0735251 2.276612 ] [ 0.5624588 1.720194 2.530042 ] [ 2.331345 1.198395 0.9085221 ] [ 2.704395 0.5611016 2.497073 ] [ 2.283372 2.154556 2.294867 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.032434e-10 1.172693e-11 4.247075e-11 ] [ 2.432392e-11 7.35251e-12 2.276612e-10 ] [ 5.624588000000001e-11 1.720194e-10 2.530042e-10 ] [ 2.331345e-10 1.198395e-10 9.085221e-11 ] [ 2.704395e-10 5.611016e-11 2.497073e-10 ] [ 2.283372e-10 2.154556e-10 2.294867e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -16.3157345 -15.7974721 -14.1551809 ] [ -10.9914622 -31.6021246 1.6261539 ] [ -21.8899723 28.9347954 11.4794557 ] [ 18.2910657 4.2697678 -49.1996213 ] [ 20.8383056 -46.8318144 28.8519205 ] [ 10.0677978 61.0268479 21.3972721 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.614068836707998e-08 -2.531034046636028e-08 -2.26790999011747e-08 ] [ -1.761026376524694e-08 -5.063218520172856e-08 2.605385760402741e-09 ] [ -3.50716018490196e-08 4.635865271751138e-08 1.83921155420493e-08 ] [ 2.930551783405679e-08 6.840922145404651e-09 -7.882648299907369e-08 ] [ 3.338664604940572e-08 -7.503283814132479e-08 4.622587249028024e-08 ] [ 1.613039025810167e-08 9.777578894649756e-08 3.428220910751611e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 23.513347 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.767253484015782e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.7744401 -0.0644062 0.0729961 ] [ 0.4584761 -0.1393548 2.3927727 ] [ 0.0880602 2.1438456 2.7865888 ] [ 2.7080461 1.1660173 0.5177256 ] [ 2.7586084 0.1838993 2.7022239 ] [ 2.369613 2.5350397 2.4595165 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.744401e-11 -6.44062e-12 7.29961e-12 ] [ 4.584761e-11 -1.393548e-11 2.3927727e-10 ] [ 8.806020000000001e-12 2.1438456e-10 2.7865888e-10 ] [ 2.7080461e-10 1.1660173e-10 5.177256e-11 ] [ 2.7586084e-10 1.838993e-11 2.7022239e-10 ] [ 2.369613e-10 2.5350397e-10 2.4595165e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0016297 0.0114343 0.0084749 ] [ -0.0185452 0.0511185 -0.0308161 ] [ 0.0006209 -0.0337741 0.0461697 ] [ 0.033399 -0.0267435 0.0078839 ] [ 0.0161419 0.0458686 0.004344 ] [ -0.0299867 -0.0479038 -0.0360565 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.61106723891776e-12 1.831976813521344e-11 1.357828664361792e-11 ] [ -2.971268586806016e-11 8.19008655903648e-11 -4.937283496423488e-11 ] [ 9.9479146385472e-13 -5.411207340856128e-11 7.397201392934976e-11 ] [ 5.35110969580992e-11 -4.28478104583648e-11 1.263140026072512e-11 ] [ 2.586217479529152e-11 7.348959854882688e-11 6.9598552407552e-12 ] [ -4.804398967494336e-11 -7.675034840747904e-11 -5.776888132787519e-11 ] ] } "relaxed-potential-energy" { "source-value" -18.118602 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.902920052598012e-18 } }