{ "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" [ [ 1.999551 1.685791 2.486539 ] [ 2.806467 1.943327 4.558328 ] [ 1.52714 3.922099 3.002179 ] [ 4.336396 2.072479 2.061694 ] [ 5.046676 1.88237 4.081611 ] [ 3.556935 4.352885 1.849563 ] [ 3.300335 4.140991 4.307093 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.999551e-10 1.685791e-10 2.486539e-10 ] [ 2.806467e-10 1.943327e-10 4.558328e-10 ] [ 1.52714e-10 3.922099e-10 3.002179e-10 ] [ 4.336396e-10 2.072479e-10 2.061694e-10 ] [ 5.046676e-10 1.88237e-10 4.081611e-10 ] [ 3.556935e-10 4.352885e-10 1.849563e-10 ] [ 3.300335e-10 4.140991e-10 4.307093e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.7658179 -1.0022287 -2.3205986 ] [ -2.7796207 -1.8599469 5.9137276 ] [ -2.9202695 0.0542888 -1.5480015 ] [ 0.7028825 0.6145117 -6.59882 ] [ 1.4343562 0.7680426 2.9138148 ] [ 0.5966997 -0.1673471 0.170909 ] [ 3.7317697 1.5926795 1.4689686 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.226975535170152e-09 -1.605747391834777e-09 -3.718008823181211e-09 ] [ -4.453443300231731e-09 -2.979963439109435e-09 9.474836102499693e-09 ] [ -4.678787519335305e-09 8.698024613128704e-11 -2.480171812263331e-09 ] [ 1.126141908669456e-09 9.845562789480634e-10 -1.057247512886746e-08 ] [ 2.298091969539529e-09 1.230539897498446e-09 4.668445949901028e-09 ] [ 9.560183089783737e-10 -2.681196111786797e-10 2.738264040843072e-10 ] [ 5.97895416754983e-09 2.551753859327434e-09 2.353547147609307e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -20.302308 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.252788322588081e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.8683542 1.5848307 2.6157107 ] [ 2.8726875 1.7012388 4.76093 ] [ 1.6566554 3.9463215 2.66812 ] [ 4.0248341 1.8731229 1.6719509 ] [ 4.9517618 2.5454306 3.8192324 ] [ 4.0342671 4.2393437 2.2402082 ] [ 3.1649399 4.1096537 4.5708547 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.8683542e-10 1.5848307e-10 2.6157107e-10 ] [ 2.8726875e-10 1.7012388e-10 4.76093e-10 ] [ 1.6566554e-10 3.9463215e-10 2.66812e-10 ] [ 4.0248341e-10 1.8731229e-10 1.6719509e-10 ] [ 4.9517618e-10 2.5454306e-10 3.8192324e-10 ] [ 4.0342671e-10 4.2393437e-10 2.2402082e-10 ] [ 3.1649399e-10 4.1096537e-10 4.5708547e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2e-05 -2.57e-05 -1.61e-05 ] [ -1.05e-05 9e-06 -1.4e-05 ] [ 5.5e-06 -1.62e-05 4.6e-06 ] [ 8e-07 5.9e-06 1.12e-05 ] [ -7e-06 1.31e-05 -3.5e-06 ] [ -2.8e-06 -1e-07 1.65e-05 ] [ 3.39e-05 1.4e-05 1.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.2043532416e-14 -4.117593915456e-14 -2.579504359488e-14 ] [ -1.68228545184e-14 1.44195895872e-14 -2.24304726912e-14 ] [ 8.8119714144e-15 -2.595526125696e-14 7.370012455680001e-15 ] [ 1.28174129664e-15 9.45284206272e-15 1.794437815296e-14 ] [ -1.12152363456e-14 2.098851373248e-14 -5.6076181728e-15 ] [ -4.48609453824e-15 -1.6021766208e-16 2.64359142432e-14 ] [ 5.431378744512e-14 2.24304726912e-14 1.92261194496e-15 ] ] } "relaxed-potential-energy" { "source-value" -22.567926 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.615780341714446e-18 } }