{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.08267 0.385996 1.67532 ] [ 0.7413004 2.189146 0.0242846 ] [ 0.0452684 1.636125 2.5153 ] [ 2.351375 1.598321 0.2166547 ] [ 2.147702 1.718144 2.949578 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.08267e-10 3.85996e-11 1.67532e-10 ] [ 7.413004e-11 2.189146e-10 2.42846e-12 ] [ 4.52684e-12 1.636125e-10 2.5153e-10 ] [ 2.351375e-10 1.598321e-10 2.166547e-11 ] [ 2.147702e-10 1.718144e-10 2.949578e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -17.0357113 0.6228293 1.0772283 ] [ -32.5091346 9.8179225 0.3330224 ] [ -2.7796231 -9.4034125 -11.5338249 ] [ 34.7074902 -9.0700643 2.5895099 ] [ 17.6169788 8.032725 7.5340642 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.729421836355838e-08 9.978825432092296e-10 1.725909997524129e-09 ] [ -5.208537541856036e-08 1.573004589432629e-08 5.335607034827059e-10 ] [ -4.453447145455621e-09 -1.506592766323848e-08 -1.84792246031809e-08 ] [ 5.560752936508513e-08 -1.453184497061272e-08 4.148852221110146e-09 ] [ 2.822551156248924e-08 1.286984419631568e-08 1.207090152084626e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -2.0252743 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.244847134167086e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.2940841 0.1426557 1.8291105 ] [ 0.7349494 2.6713919 0.0742282 ] [ 0.0282808 1.5070611 2.1334021 ] [ 2.0488674 1.2549932 -0.2417278 ] [ 2.2621341 1.9516301 3.5861243 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.2940841e-10 1.426557e-11 1.8291105e-10 ] [ 7.349494e-11 2.6713919e-10 7.42282e-12 ] [ 2.82808e-12 1.5070611e-10 2.1334021e-10 ] [ 2.0488674e-10 1.2549932e-10 -2.417278e-11 ] [ 2.2621341e-10 1.9516301e-10 3.5861243e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -9.8e-06 -0.0001395 -5.93e-05 ] [ -1.32e-05 -3.71e-05 -1.09e-05 ] [ 4.06e-05 8.15e-05 4.5e-06 ] [ -8.7e-06 6.38e-05 0.0001213 ] [ -8.9e-06 3.14e-05 -5.57e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.570133088384e-14 -2.235036386016e-13 -9.500907361344e-14 ] [ -2.114873139456e-14 -5.944075263168e-14 -1.746372516672e-14 ] [ 6.504837080448e-14 1.305773945952e-13 7.2097947936e-15 ] [ -1.393893660096e-14 1.0221886840704e-13 1.9434402410304e-13 ] [ -1.425937192512e-14 5.030834589312e-14 -8.924123777856e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.023506 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.766160359244852e-18 } }