{ "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" [ [ 1.971858 1.613185 3.540739 ] [ 1.980532 3.696797 1.101352 ] [ 1.421419 3.841396 3.166588 ] [ 2.933735 5.314328 3.389927 ] [ 3.610376 2.128489 1.767833 ] [ 4.452161 4.502678 1.60274 ] [ 4.038762 3.260824 3.402783 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.971858e-10 1.613185e-10 3.540739e-10 ] [ 1.980532e-10 3.696797e-10 1.101352e-10 ] [ 1.421419e-10 3.841396e-10 3.166588e-10 ] [ 2.933735e-10 5.314328e-10 3.389927e-10 ] [ 3.610376e-10 2.128489e-10 1.767833e-10 ] [ 4.452161e-10 4.502678000000001e-10 1.60274e-10 ] [ 4.038762e-10 3.260824e-10 3.402783e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.1625969 0.4221383 -0.2742538 ] [ 0.7453053 1.2634535 -2.5972489 ] [ -4.7488006 -1.2593203 2.9413041 ] [ 1.5863555 1.6064688 -0.9333255 ] [ -0.3744639 -2.7110178 -3.4740472 ] [ 0.1140182 0.6442338 -1.8877979 ] [ 1.5149888 0.0340437 6.2253693 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.862685572594556e-09 6.763401150042567e-10 -4.394030265255591e-10 ] [ 1.19411072701833e-09 2.024275659167933e-09 -4.161251465978517e-09 ] [ -7.608417298161014e-09 -2.017653542758842e-09 4.712488663683185e-09 ] [ 2.541621694377494e-09 2.573846753404631e-09 -1.49535229569647e-09 ] [ -5.999573059135891e-10 -4.34352933773265e-09 -5.566037203395702e-09 ] [ 1.826772943856986e-10 1.032176332689143e-09 -3.024585660175337e-09 ] [ 2.427279636133847e-09 5.454402022552897e-11 9.974141148306061e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -28.534894 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.57179400438062e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0192596 1.8250176 2.9470846 ] [ 1.903449 3.7134098 1.1967603 ] [ 1.4334536 3.8602233 3.7267027 ] [ 2.8958499 5.3695199 2.9042316 ] [ 3.8437016 2.0764864 1.6427804 ] [ 4.38548 4.2671061 1.6163165 ] [ 3.9276493 3.245934 3.9380859 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0192596e-10 1.8250176e-10 2.9470846e-10 ] [ 1.903449e-10 3.7134098e-10 1.1967603e-10 ] [ 1.4334536e-10 3.8602233e-10 3.7267027e-10 ] [ 2.8958499e-10 5.369519900000001e-10 2.9042316e-10 ] [ 3.8437016e-10 2.0764864e-10 1.6427804e-10 ] [ 4.38548e-10 4.2671061e-10 1.6163165e-10 ] [ 3.9276493e-10 3.245934e-10 3.9380859e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.1e-06 5.8e-06 -5.9e-06 ] [ 5e-06 -1.34e-05 3.7e-06 ] [ 6.3e-06 3.5e-06 -5e-06 ] [ 9.1e-06 -1.19e-05 5.3e-06 ] [ -5e-07 1.66e-05 7.9e-06 ] [ -1.23e-05 -2e-07 -4e-06 ] [ -4.5e-06 -4e-07 -1.9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.96674752448e-15 9.292624400640001e-15 -9.45284206272e-15 ] [ 8.010883104e-15 -2.146916671872e-14 5.928053496960001e-15 ] [ 1.009371271104e-14 5.6076181728e-15 -8.010883104e-15 ] [ 1.457980724928e-14 -1.906590178752e-14 8.491536090240001e-15 ] [ -8.010883104e-16 2.659613190528e-14 1.265719530432e-14 ] [ -1.970677243584e-14 -3.2043532416e-16 -6.4087064832e-15 ] [ -7.2097947936e-15 -6.408706483200001e-16 -3.04413557952e-15 ] ] } "relaxed-potential-energy" { "source-value" -32.399964 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.191046483556165e-18 } }