{ "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" [ [ 0.284773 1.136187 2.117179 ] [ 0.232979 2.36751 0.607179 ] [ 0.4870779 2.766051 2.845032 ] [ 1.778488 1.070505 1.035652 ] [ 2.177899 0.7799475 2.527686 ] [ 2.528264 2.860392 0.629956 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.84773e-11 1.136187e-10 2.117179e-10 ] [ 2.32979e-11 2.36751e-10 6.07179e-11 ] [ 4.870779e-11 2.766051e-10 2.845032e-10 ] [ 1.778488e-10 1.070505e-10 1.035652e-10 ] [ 2.177899e-10 7.799475000000001e-11 2.527686e-10 ] [ 2.528264e-10 2.860392e-10 6.29956e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -26.8786299 -20.3417102 10.5856003 ] [ -12.4686793 12.8655796 -16.4126656 ] [ -1.7340788 20.745597 15.2391896 ] [ 11.1775176 -12.9420377 -43.2374188 ] [ 21.7243303 -11.3778962 37.1197156 ] [ 8.1795401 11.0504675 -3.2944212 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.306431242491584e-08 -3.25910125095289e-08 1.696000131779347e-08 ] [ -1.997702646671291e-08 2.061293084816142e-08 -2.62959891093284e-08 ] [ -2.778300511984919e-09 3.323811049793862e-08 2.441587329705851e-08 ] [ 1.790835737730053e-08 -2.073543022845221e-08 -6.927398154509839e-08 ] [ 3.480621410919705e-08 -1.822939928552916e-08 5.947234050506505e-08 ] [ 1.310506791711609e-08 1.770480067741022e-08 -5.278244625707881e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 10.646307 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.705726417325939e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.0526483 0.7057504 2.1927836 ] [ 0.1001004 2.5569006 0.4312927 ] [ 0.7325909 3.0483225 2.8626296 ] [ 1.7639028 0.6118749 0.3915984 ] [ 2.3963932 1.1032971 2.8229352 ] [ 2.5491419 2.9544471 1.0614445 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -5.26483e-12 7.057504e-11 2.1927836e-10 ] [ 1.001004e-11 2.5569006e-10 4.312927e-11 ] [ 7.325909e-11 3.0483225e-10 2.8626296e-10 ] [ 1.7639028e-10 6.118749e-11 3.915984e-11 ] [ 2.3963932e-10 1.1032971e-10 2.8229352e-10 ] [ 2.5491419e-10 2.9544471e-10 1.0614445e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1e-07 7e-07 -6e-07 ] [ 1e-07 -8e-07 8e-07 ] [ -1.4e-06 7e-07 4e-07 ] [ -5e-07 0.0 -4e-07 ] [ 7e-07 -1.5e-06 1.3e-06 ] [ 8e-07 9e-07 -1.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.6021766208e-16 1.12152363456e-15 -9.6130597248e-16 ] [ 1.6021766208e-16 -1.28174129664e-15 1.28174129664e-15 ] [ -2.24304726912e-15 1.12152363456e-15 6.408706483200001e-16 ] [ -8.010883104e-16 0.0 -6.408706483200001e-16 ] [ 1.12152363456e-15 -2.4032649312e-15 2.08282960704e-15 ] [ 1.28174129664e-15 1.44195895872e-15 -2.24304726912e-15 ] ] } "relaxed-potential-energy" { "source-value" -20.222449 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.239993500312034e-18 } }