{ "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" [ [ 0.468554 0.0062453 1.779472 ] [ 0.0137549 1.819656 0.3703857 ] [ 0.6368997 2.724291 2.946976 ] [ 2.361208 0.5254432 0.0878272 ] [ 1.952332 1.317185 1.267695 ] [ 2.764287 2.133831 2.76552 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.685540000000001e-11 6.2453e-13 1.779472e-10 ] [ 1.37549e-12 1.819656e-10 3.703857e-11 ] [ 6.368997e-11 2.724291e-10 2.946976e-10 ] [ 2.361208e-10 5.254432e-11 8.782719999999999e-12 ] [ 1.952332e-10 1.317185e-10 1.267695e-10 ] [ 2.764287e-10 2.133831e-10 2.76552e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -10.7602881 -13.1370159 7.3711316 ] [ -9.0951097 6.2991978 -4.7697721 ] [ -5.9471552 4.6502543 3.2363659 ] [ 34.8019514 -58.6788335 -90.0275148 ] [ -19.1673938 55.0214888 72.3746633 ] [ 10.1679953 5.8449085 11.8151261 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.723988216892825e-08 -2.104781991546648e-08 1.180985481565903e-08 ] [ -1.457197224500675e-08 1.009242752810421e-08 -7.642017408125111e-09 ] [ -9.528393100211597e-09 7.450528781618026e-09 5.18522982405438e-09 ] [ 5.575887335068358e-08 -9.401385594407644e-08 -1.442399806296492e-07 ] [ -3.070955048103647e-08 8.815414372325269e-08 1.159569944328773e-07 ] [ 1.629092448428182e-08 9.364575826567988e-09 1.892991896518355e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 28.748249 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.605977281621387e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.3191167 -0.8540201 2.4705451 ] [ -0.2624142 2.4482611 0.1770165 ] [ 0.6972463 3.1272964 2.5493644 ] [ 2.9443873 0.7639922 -0.410118 ] [ 1.4170858 0.9666331 1.4164499 ] [ 3.0816136 2.0744889 3.0146179 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.191167e-11 -8.540201e-11 2.4705451e-10 ] [ -2.624142e-11 2.4482611e-10 1.770165e-11 ] [ 6.972463e-11 3.1272964e-10 2.5493644e-10 ] [ 2.9443873e-10 7.639922e-11 -4.10118e-11 ] [ 1.4170858e-10 9.666331e-11 1.4164499e-10 ] [ 3.0816136e-10 2.0744889e-10 3.0146179e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.2e-06 -1.03e-05 5.1e-06 ] [ 2.8e-06 1.3e-06 7e-07 ] [ 3.2e-06 -7.2e-06 -4.9e-06 ] [ 2.6e-06 -5.9e-06 -9.9e-06 ] [ -2.8e-06 2.5e-05 6.6e-06 ] [ -7e-06 -2.8e-06 2.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.9226119608e-15 -1.65024193302e-14 8.1711008334e-15 ] [ 4.486094575199999e-15 2.0828296242e-15 1.1215236438e-15 ] [ 5.1269652288e-15 -1.15356717648e-14 -7.850665506599998e-15 ] [ 4.165659248399999e-15 -9.452842140600001e-15 -1.58615486766e-14 ] [ -4.486094575199999e-15 4.005441585e-14 1.05743657844e-14 ] [ -1.1215236438e-14 -4.486094575199999e-15 3.845223921599999e-15 ] ] } "relaxed-potential-energy" { "source-value" -14.20969 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.276643329438346e-18 } }