{ "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" [ [ 0.5094065 0.6220131 0.2703167 ] [ 0.4530106 0.160144 2.650194 ] [ 0.6482707 2.949508 2.588273 ] [ 2.962565 0.672996 2.425796 ] [ 1.742585 2.553059 0.6145101 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.094065e-11 6.220131e-11 2.703167e-11 ] [ 4.530106e-11 1.60144e-11 2.650194e-10 ] [ 6.482707e-11 2.949508e-10 2.588273e-10 ] [ 2.962565e-10 6.72996e-11 2.425796e-10 ] [ 1.742585e-10 2.553059e-10 6.145100999999999e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.351024 -0.636778 -0.1177117 ] [ 1.2576772 4.9346278 -0.3359259 ] [ -0.7968836 -4.4095761 1.1370074 ] [ -1.9576551 1.4637669 -1.452316 ] [ 1.8478854 -1.3520406 0.7689462 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.62402450773216e-10 -1.020230832645252e-09 -1.885949352884178e-10 ] [ 2.015021022954545e-09 7.906145358646826e-09 -5.382126277354205e-10 ] [ -1.276748283937802e-09 -7.064919793264846e-09 1.821686688965091e-09 ] [ -3.136509258650933e-09 2.345213124802615e-09 -2.326866760384344e-09 ] [ 2.960638810189743e-09 -2.16620785753934e-09 1.231987634443091e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.4314723 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.511088454327824e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.3704298 0.5807847 0.1911408 ] [ 0.5857355 0.418417 2.6275588 ] [ 0.4261697 2.8643744 2.6537146 ] [ 2.9929052 0.7294624 2.2845887 ] [ 1.9405974 2.3646815 0.7920869 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.704298e-11 5.807847e-11 1.911408e-11 ] [ 5.857355e-11 4.18417e-11 2.6275588e-10 ] [ 4.261697e-11 2.8643744e-10 2.6537146e-10 ] [ 2.9929052e-10 7.294623999999999e-11 2.2845887e-10 ] [ 1.9405974e-10 2.3646815e-10 7.920869000000001e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.1e-05 6.3e-06 1.9e-06 ] [ 4.9e-06 1.95e-05 -2.46e-05 ] [ 5.6e-06 -1.45e-05 4.2e-06 ] [ 3.7e-06 2.01e-05 7.1e-06 ] [ -3.2e-06 -3.14e-05 1.14e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.7623942974e-14 1.00937127942e-14 3.0441356046e-15 ] [ 7.850665506599998e-15 3.1242444363e-14 -3.94135451964e-14 ] [ 8.972189150399999e-15 -2.3231561193e-14 6.729141862799999e-15 ] [ 5.9280535458e-15 3.22037503434e-14 1.13754541014e-14 ] [ -5.1269652288e-15 -5.030834630759999e-14 1.82648136276e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.950872 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.754523124032485e-18 } }