{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.298469 1.653345 1.333865 ] [ 0.8562694 1.609736 3.078689 ] [ 0.6106735 3.571622 1.917701 ] [ 2.573163 3.601998 2.791817 ] [ 3.634663 1.831744 3.381139 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.298469e-10 1.653345e-10 1.333865e-10 ] [ 8.562694e-11 1.609736e-10 3.078689e-10 ] [ 6.106735e-11 3.571622e-10 1.917701e-10 ] [ 2.573163e-10 3.601998e-10 2.791817e-10 ] [ 3.634663e-10 1.831744e-10 3.381139e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.1818548 -1.4765728 -2.2472196 ] [ -1.9582285 -1.8294077 1.7170027 ] [ -2.6480314 1.1485114 -1.1554213 ] [ 1.9698742 4.2193962 0.7905497 ] [ 1.4545309 -2.0619271 0.8950884 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.89354012974026e-09 -2.365730419069194e-09 -3.600442704923528e-09 ] [ -3.137427920884253e-09 -2.9310342468515e-09 2.750941583790477e-09 ] [ -4.242614000224293e-09 1.840118113802277e-09 -1.851188994034343e-09 ] [ 3.156086389157104e-09 6.760217945532362e-09 1.266600246920454e-09 ] [ 2.330415402211182e-09 -3.303571393413944e-09 1.434089708029279e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -8.6081773 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.379182041776127e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.218708 1.4739629 1.0319081 ] [ 0.8338898 1.3918106 3.332679 ] [ 0.8584642 3.3920292 1.8502797 ] [ 2.7810212 4.1676618 3.0351722 ] [ 3.2811548 1.8429805 3.253172 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.218708e-10 1.4739629e-10 1.0319081e-10 ] [ 8.338898e-11 1.3918106e-10 3.332679e-10 ] [ 8.584642000000001e-11 3.3920292e-10 1.8502797e-10 ] [ 2.7810212e-10 4.1676618e-10 3.0351722e-10 ] [ 3.2811548e-10 1.8429805e-10 3.253172e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6.2e-06 3.9e-06 -5e-07 ] [ -2.8e-06 -7e-07 9e-07 ] [ -2.3e-06 -3.4e-06 5.1e-06 ] [ 3.7e-06 2.9e-06 -5.3e-06 ] [ -4.8e-06 -2.7e-06 -3e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.93349504896e-15 6.24848882112e-15 -8.010883104e-16 ] [ -4.48609453824e-15 -1.12152363456e-15 1.44195895872e-15 ] [ -3.68500622784e-15 -5.44740051072e-15 8.17110076608e-15 ] [ 5.928053496960001e-15 4.646312200320001e-15 -8.491536090240001e-15 ] [ -7.69044777984e-15 -4.32587687616e-15 -4.8065298624e-16 ] ] } "relaxed-potential-energy" { "source-value" -10.393797 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.665269855474118e-18 } }