{ "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" [ [ 2.167127 3.726278 2.425808 ] [ 5.703742 2.419847 2.282123 ] [ 3.651151 2.438119 0.811047 ] [ 3.941822 0.8653656 2.619853 ] [ 4.06698 3.157982 3.365965 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.167127e-10 3.726278000000001e-10 2.425808e-10 ] [ 5.703742000000001e-10 2.419847e-10 2.282123e-10 ] [ 3.651151e-10 2.438119e-10 8.11047e-11 ] [ 3.941822e-10 8.653656e-11 2.619853e-10 ] [ 4.06698e-10 3.157982e-10 3.365965e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.7219676 -0.0473226 -1.9546174 ] [ 8.7856573 1.5912428 -1.8697932 ] [ -3.2320714 2.0311149 -3.2922823 ] [ -3.266349 -8.5495634 1.3652158 ] [ -1.5652693 4.9745283 5.7514772 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.156719609695086e-09 -7.581916335547008e-11 -3.131642300888882e-09 ] [ 1.407617472442085e-08 2.54945201217633e-09 -2.995738950770819e-09 ] [ -5.178349233836326e-09 3.25420480693853e-09 -5.274817730133653e-09 ] [ -5.233268003173459e-09 -1.369791059752736e-08 2.187316837106769e-09 ] [ -2.507837877715981e-09 7.970072941767969e-09 9.214882304904245e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.717296 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.037535433099336e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.2076116 4.0319983 2.1732755 ] [ 5.837119 2.5156169 2.0569836 ] [ 3.5244297 2.4230236 0.9976649 ] [ 4.1102657 0.6286925 2.7054457 ] [ 3.851396 3.0082603 3.5714262 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2076116e-10 4.0319983e-10 2.1732755e-10 ] [ 5.837119e-10 2.5156169e-10 2.0569836e-10 ] [ 3.5244297e-10 2.4230236e-10 9.976649e-11 ] [ 4.110265700000001e-10 6.286925e-11 2.7054457e-10 ] [ 3.851396e-10 3.0082603e-10 3.5714262e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.35e-05 8.66e-05 1.02e-05 ] [ -2.77e-05 -5.79e-05 6.36e-05 ] [ -3.11e-05 -7.65e-05 1.07e-05 ] [ 9.16e-05 4.54e-05 -6.36e-05 ] [ 7e-07 2.4e-06 -2.09e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.36729167968e-14 1.3874849536128e-13 1.634220153216e-14 ] [ -4.438029239616e-14 -9.276602634432e-14 1.0189843308288e-13 ] [ -4.982769290688e-14 -1.225665114912e-13 1.714328984256e-14 ] [ 1.4675937846528e-13 7.273881858432e-14 -1.0189843308288e-13 ] [ 1.12152363456e-15 3.84522388992e-15 -3.348549137472e-14 ] ] } "relaxed-potential-energy" { "source-value" -15.499658 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.483318967799569e-18 } }