{ "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" [ [ 2.072399 2.177963 4.557602 ] [ 2.377271 3.879759 3.040396 ] [ 5.261436 0.7705425 2.642102 ] [ 4.650297 3.074511 2.607434 ] [ 3.240336 1.703827 1.872622 ] [ 3.483569 0.4560924 3.818111 ] [ 3.60342 3.885532 5.130911 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.072399e-10 2.177963e-10 4.557602e-10 ] [ 2.377271e-10 3.879759e-10 3.040396e-10 ] [ 5.261436e-10 7.705425e-11 2.642102e-10 ] [ 4.650297000000001e-10 3.074511e-10 2.607434e-10 ] [ 3.240336e-10 1.703827e-10 1.872622e-10 ] [ 3.483569e-10 4.560924000000001e-11 3.818111e-10 ] [ 3.60342e-10 3.885532e-10 5.130911000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.318823 -2.2189567 4.066663 ] [ -3.2981553 3.8947451 -2.2866362 ] [ 7.1624261 -3.3609426 -0.2095017 ] [ 6.5860226 7.8509888 -1.1915395 ] [ -5.6782903 -1.7514204 -8.7889243 ] [ -3.5567755 -5.972487 5.4331028 ] [ 2.1035953 1.5580729 2.9768358 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.317340619173319e-09 -3.555160547307519e-09 6.515512383272391e-09 ] [ -5.284227313427611e-09 6.240069543195359e-09 -3.663595059914953e-09 ] [ 1.147547164562772e-08 -5.384823657570766e-09 -3.356587257578554e-10 ] [ 1.055197143378043e-08 1.257867070552265e-08 -1.909056729659722e-09 ] [ -9.097623964775418e-09 -2.806084818072185e-09 -1.408140903544101e-08 ] [ -5.698582551534231e-09 -9.56897903943193e-09 8.704790284563018e-09 ] [ 3.370331209284762e-09 2.496307973882057e-09 4.769416722720464e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -4.2383107 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.790522315226484e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.2554247 2.325483 4.6979744 ] [ 2.4992504 3.4810541 2.459422 ] [ 5.3384678 1.293557 3.0702977 ] [ 4.8504439 3.607164 3.0625585 ] [ 2.338335 1.3037485 1.4818317 ] [ 3.1934118 0.4113258 3.5300853 ] [ 4.2133945 3.5258945 5.3670085 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2554247e-10 2.325483e-10 4.697974399999999e-10 ] [ 2.4992504e-10 3.4810541e-10 2.459422e-10 ] [ 5.3384678e-10 1.293557e-10 3.0702977e-10 ] [ 4.8504439e-10 3.607164e-10 3.0625585e-10 ] [ 2.338335e-10 1.3037485e-10 1.4818317e-10 ] [ 3.1934118e-10 4.113258e-11 3.5300853e-10 ] [ 4.2133945e-10 3.525894500000001e-10 5.3670085e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.8e-06 -1.9e-06 7.9e-06 ] [ 1.11e-05 -3.9e-06 -1.77e-05 ] [ -0.0 -2.4e-06 -6.9e-06 ] [ -1.2e-05 7.4e-06 -0.0 ] [ -1e-07 7.9e-06 1e-07 ] [ 5.1e-06 8.7e-06 1.67e-05 ] [ 8e-07 -1.57e-05 -1e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.69044777984e-15 -3.04413557952e-15 1.265719530432e-14 ] [ 1.778416049088e-14 -6.24848882112e-15 -2.835852618816e-14 ] [ 0.0 -3.84522388992e-15 -1.105501868352e-14 ] [ -1.92261194496e-14 1.185610699392e-14 0.0 ] [ -1.6021766208e-16 1.265719530432e-14 1.6021766208e-16 ] [ 8.17110076608e-15 1.393893660096e-14 2.675634956736e-14 ] [ 1.28174129664e-15 -2.515417294656e-14 -1.6021766208e-16 ] ] } "relaxed-potential-energy" { "source-value" -11.906007 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.907552606248115e-18 } }