{ "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" [ [ 2.428537 1.662164 2.065612 ] [ 2.677805 2.654077 4.303636 ] [ 2.380622 3.799595 2.643621 ] [ 4.65403 2.78928 1.862185 ] [ 4.978196 2.955414 4.623231 ] [ 4.975087 5.409268 1.773954 ] [ 3.793479 4.953224 3.972917 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.428537e-10 1.662164e-10 2.065612e-10 ] [ 2.677805e-10 2.654077e-10 4.303636e-10 ] [ 2.380622e-10 3.799595e-10 2.643621e-10 ] [ 4.65403e-10 2.78928e-10 1.862185e-10 ] [ 4.978196e-10 2.955414e-10 4.623231e-10 ] [ 4.975087000000001e-10 5.409268e-10 1.773954e-10 ] [ 3.793479e-10 4.953223999999999e-10 3.972917e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.2698621 -4.9246201 -1.8804945 ] [ -0.7091469 -5.9164307 8.774207 ] [ -3.788724 8.0211004 -8.5707853 ] [ 1.0743205 1.3360037 3.1806455 ] [ 1.8541298 -0.9973302 -3.1070611 ] [ -0.2514217 -1.0260483 0.7316494 ] [ 2.0907044 3.5073252 0.871839 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.323667474599917e-10 -7.89011119054176e-09 -3.012884323442986e-09 ] [ -1.136178583892795e-09 -9.47916694612338e-09 1.405782932145971e-08 ] [ -6.070205015463859e-09 1.285121953396953e-08 -1.373191182955632e-08 ] [ 1.721251188346166e-09 2.140513893442297e-09 5.095955859152726e-09 ] [ 2.97064341748858e-09 -1.597899129657788e-09 -4.978060653817131e-09 ] [ -4.028219697017914e-10 -1.643910598071585e-09 1.172231563302347e-09 ] [ 3.349677710683692e-09 5.619354436982684e-09 1.396840062901651e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.658742 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.028154048113903e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.5345637 1.5094015 2.0002008 ] [ 2.5092257 1.9350907 4.5032872 ] [ 2.228627 3.9374115 2.9061713 ] [ 4.5768739 3.0226217 1.9530409 ] [ 4.646579 3.1104913 4.4769839 ] [ 5.3281061 5.320817 1.6796498 ] [ 4.0637806 5.3871884 3.725822 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5345637e-10 1.5094015e-10 2.0002008e-10 ] [ 2.5092257e-10 1.9350907e-10 4.5032872e-10 ] [ 2.228627e-10 3.9374115e-10 2.9061713e-10 ] [ 4.5768739e-10 3.0226217e-10 1.9530409e-10 ] [ 4.646579e-10 3.1104913e-10 4.4769839e-10 ] [ 5.328106100000001e-10 5.320817e-10 1.6796498e-10 ] [ 4.0637806e-10 5.387188400000001e-10 3.725822e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 7.12e-05 1.88e-05 1.5e-06 ] [ -0.0001149 3.17e-05 -3.49e-05 ] [ 0.0002476 -6.15e-05 0.0001248 ] [ -1.27e-05 -7.42e-05 7.51e-05 ] [ -0.0001807 0.0001203 -0.0001187 ] [ -0.0001477 0.0001158 -1.45e-05 ] [ 0.0001374 -0.000151 -3.32e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.1407497540096e-13 3.012092047104e-14 2.4032649312e-15 ] [ -1.8409009372992e-13 5.078899887936e-14 -5.591596406592e-14 ] [ 3.9669893131008e-13 -9.853386217920001e-14 1.9995164227584e-13 ] [ -2.034764308416e-14 -1.1888150526336e-13 1.2032346422208e-13 ] [ -2.8951331537856e-13 1.9274184748224e-13 -1.9017836488896e-13 ] [ -2.3664148689216e-13 1.8553205268864e-13 -2.32315610016e-14 ] [ 2.2013906769792e-13 -2.419286697408e-13 -5.319226381056e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.192907 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.754607363898867e-18 } }