{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.3769553e-10 2.898422e-10 1.8920771e-10 ] [ 3.1278656e-10 5.184066000000001e-11 1.9779299e-10 ] [ 4.8203433e-10 3.2607829e-10 1.527402e-10 ] [ 3.1281406e-10 2.8260729e-10 4.2722932e-10 ] [ 5.0071531e-10 1.5051839e-10 3.2930818e-10 ] ] "source-value" [ [ 2.3769553 2.898422 1.8920771 ] [ 3.1278656 0.5184066 1.9779299 ] [ 4.8203433 3.2607829 1.527402 ] [ 3.1281406 2.8260729 4.2722932 ] [ 5.0071531 1.5051839 3.2930818 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 5.4842505729984e-13 -2.49923531078592e-12 8.8071648845376e-13 ] [ 1.01513910693888e-12 5.86380621446592e-12 2.21613070189056e-12 ] [ -2.5538695335552e-13 -1.0326028321056e-12 6.681076508736e-14 ] [ -5.1942566046336e-13 -1.5332830261056e-12 -2.30585259265536e-12 ] [ -7.887515504198399e-13 -7.9852482780672e-13 -8.5780536277632e-13 ] ] "source-value" [ [ 0.0003423 -0.0015599 0.0005497 ] [ 0.0006336 0.0036599 0.0013832 ] [ -0.0001594 -0.0006445 4.17e-05 ] [ -0.0003242 -0.000957 -0.0014392 ] [ -0.0004923 -0.0004984 -0.0005354 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -1.835851677678749e-18 "source-value" -11.458485 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -8.636383270908356e-09 5.082171853030998e-09 3.775140358649332e-09 ] [ -2.288051449092299e-09 -1.145049371210945e-08 -2.025401188244045e-09 ] [ 9.074131569419951e-09 7.963871717157162e-09 -4.275297121547317e-09 ] [ -1.458487493393159e-09 -3.383604761935104e-11 -2.292120176620821e-09 ] [ 3.308790643973862e-09 -1.561713650241696e-09 4.817678287980513e-09 ] ] "source-value" [ [ -5.3904065 3.1720422 2.3562573 ] [ -1.4280894 -7.1468361 -1.264156 ] [ 5.6636275 4.9706578 -2.6684306 ] [ -0.9103163 -0.0211188 -1.4306289 ] [ 2.0651847 -0.974745 3.0069583 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -1.349612991042121e-18 "source-value" -8.4236218 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.316837e-10 2.864638e-10 1.901515e-10 ] [ 3.52699e-10 8.132212e-11 1.584521e-10 ] [ 4.498469e-10 2.850966e-10 1.401087e-10 ] [ 3.329161e-10 3.035367e-10 4.525662e-10 ] [ 4.789001e-10 1.444676e-10 3.549999e-10 ] ] "source-value" [ [ 2.316837 2.864638 1.901515 ] [ 3.52699 0.8132212 1.584521 ] [ 4.498469 2.850966 1.401087 ] [ 3.329161 3.035367 4.525662 ] [ 4.789001 1.444676 3.549999 ] ] } "instance-id" 1 }