{ "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" [ [ 2.019678 3.528357 2.55152 ] [ 4.681874 1.030316 1.978031 ] [ 3.876194 2.698932 0.9098523 ] [ 3.736168 1.84025 3.911189 ] [ 5.498325 3.105138 2.775129 ] [ 3.884183 4.867643 2.227305 ] [ 3.327521 4.019973 4.190113 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.019678e-10 3.528357e-10 2.55152e-10 ] [ 4.681874e-10 1.030316e-10 1.978031e-10 ] [ 3.876194e-10 2.698932e-10 9.098523e-11 ] [ 3.736168e-10 1.84025e-10 3.911189e-10 ] [ 5.498325e-10 3.105138e-10 2.775129000000001e-10 ] [ 3.884183e-10 4.867643e-10 2.227305e-10 ] [ 3.327521e-10 4.019973e-10 4.190113e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -8.816242 -5.9707463 -4.2885546 ] [ 0.0329459 -3.3224629 -1.4604945 ] [ -3.5661852 0.2708531 -6.9424462 ] [ -2.722895 -3.8125063 3.975664 ] [ 8.996315 2.709638 2.0832976 ] [ 5.4983265 6.3428439 -4.7778039 ] [ 0.5777349 3.7823804 11.4103376 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.412517681571503e-08 -9.566190130588102e-09 -6.871021917144296e-09 ] [ 5.278515073121472e-11 -5.323172381855368e-09 -2.339970142706986e-09 ] [ -5.713658552882973e-09 4.339545044912045e-10 -1.11230249928018e-08 ] [ -4.362558709893216e-09 -6.108308460512711e-09 6.369715912956212e-09 ] [ 1.441368556635235e-08 4.34131865443127e-09 3.33781070888875e-09 ] [ 8.809290171825093e-09 1.016235620596389e-08 -7.654885707347061e-09 ] [ 9.25633349800226e-10 6.060041447852152e-09 1.828137613815518e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -9.1291938 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.462658087311231e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.4538802 3.1457398 2.4635494 ] [ 4.7415112 1.3903201 2.1083725 ] [ 3.3576734 2.9549579 0.801765 ] [ 3.4835502 1.5627547 4.1285254 ] [ 6.1614209 3.2582966 3.0002442 ] [ 4.4704675 4.8062642 1.9557304 ] [ 3.3554395 3.9722758 4.0849525 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.4538802e-10 3.1457398e-10 2.4635494e-10 ] [ 4.7415112e-10 1.3903201e-10 2.1083725e-10 ] [ 3.3576734e-10 2.9549579e-10 8.01765e-11 ] [ 3.4835502e-10 1.5627547e-10 4.1285254e-10 ] [ 6.161420900000001e-10 3.2582966e-10 3.0002442e-10 ] [ 4.4704675e-10 4.8062642e-10 1.9557304e-10 ] [ 3.3554395e-10 3.9722758e-10 4.0849525e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.51e-05 -6.4e-05 -4.1e-06 ] [ -2.08e-05 -7.6e-06 -1.11e-05 ] [ 9.7e-06 1.32e-05 -1.84e-05 ] [ 1.7e-06 1.16e-05 -1.76e-05 ] [ -3.07e-05 -2.77e-05 4.24e-05 ] [ 7e-07 3.55e-05 -3.89e-05 ] [ 5.45e-05 3.9e-05 4.76e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.419286697408e-14 -1.025393037312e-13 -6.568924145279999e-15 ] [ -3.332527371264e-14 -1.217654231808e-14 -1.778416049088e-14 ] [ 1.554111322176e-14 2.114873139456e-14 -2.948004982272e-14 ] [ 2.72370025536e-15 1.858524880128e-14 -2.819830852608e-14 ] [ -4.918682225856e-14 -4.438029239616e-14 6.793228872192001e-14 ] [ 1.12152363456e-15 5.68772700384e-14 -6.232467054911999e-14 ] [ 8.731862583360001e-14 6.248488821120001e-14 7.626360715008e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.508478 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.965385073819114e-18 } }