{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 3.8620613e-10 1.9239971e-10 3.3109205e-10 ] [ 1.9878107e-10 1.4574539e-10 4.9606986e-10 ] [ 2.9419834e-10 4.455445400000001e-10 3.1100746e-10 ] [ 1.115366e-10 3.8254172e-10 4.7605093e-10 ] [ 4.48049e-10 9.420846e-11 1.0962397e-10 ] [ 3.520781e-10 3.2356643e-10 1.0263595e-10 ] [ 3.6366636e-10 3.4623945e-10 5.4441174e-10 ] ] "source-value" [ [ 3.8620613 1.9239971 3.3109205 ] [ 1.9878107 1.4574539 4.9606986 ] [ 2.9419834 4.4554454 3.1100746 ] [ 1.115366 3.8254172 4.7605093 ] [ 4.48049 0.9420846 1.0962397 ] [ 3.520781 3.2356643 1.0263595 ] [ 3.6366636 3.4623945 5.4441174 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 1.16269957371456e-12 1.023486447133248e-11 9.084341439936001e-13 ] [ 6.591354617971201e-13 1.65472801396224e-12 -4.083627771095039e-12 ] [ 8.177509472563201e-13 -8.274761593445762e-12 -1.60762402131072e-12 ] [ -7.2242143831872e-13 -2.1292927290432e-13 5.04893918512704e-12 ] [ -1.89008775955776e-12 -4.674350291183999e-12 -9.5265421872768e-13 ] [ 2.0804263421088e-12 1.61851882233216e-12 -2.52198621880128e-12 ] [ -2.10750312700032e-12 -3.4623036775488e-13 3.20867911847616e-12 ] ] "source-value" [ [ 0.0007257 0.0063881 0.000567 ] [ 0.0004114 0.0010328 -0.0025488 ] [ 0.0005104 -0.0051647 -0.0010034 ] [ -0.0004509 -0.0001329 0.0031513 ] [ -0.0011797 -0.0029175 -0.0005946 ] [ 0.0012985 0.0010102 -0.0015741 ] [ -0.0013154 -0.0002161 0.0020027 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -2.553665095818386e-18 "source-value" -15.938724 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -2.565812638739629e-09 -7.629660237540874e-09 -1.048956296939404e-08 ] [ -1.08083544603411e-08 -1.960259746999663e-08 9.408692483757235e-09 ] [ -2.732704487968896e-11 7.598612457894703e-09 -3.568149232954683e-09 ] [ -9.340315591023043e-09 5.146519431781539e-09 1.809097410940996e-09 ] [ 3.448248583142832e-09 -3.730642466489205e-09 -3.102764028604935e-10 ] [ -7.487105931834547e-10 3.130206750636645e-09 -2.635094280611587e-09 ] [ 2.004227158480642e-08 1.508756169393148e-08 5.785293151340237e-09 ] ] "source-value" [ [ -1.6014543 -4.7620594 -6.5470703 ] [ -6.7460443 -12.2349791 5.872444 ] [ -0.0170562 4.7426809 -2.2270636 ] [ -5.8297665 3.2122048 1.1291498 ] [ 2.1522275 -2.3284839 -0.1936593 ] [ -0.4673084 1.9537214 -1.6446965 ] [ 12.5094021 9.4169154 3.610896 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -1.543688490343515e-18 "source-value" -9.6349458 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.750115e-10 2.05781e-10 3.008489e-10 ] [ 2.459373e-10 1.512643e-10 5.182306e-10 ] [ 3.045421e-10 4.403069e-10 3.012822e-10 ] [ 1.351279e-10 3.64529e-10 4.777489e-10 ] [ 4.685264e-10 1.369475e-10 1.888704e-10 ] [ 3.677702e-10 3.202643e-10 9.471066000000001e-11 ] [ 3.576002e-10 3.111527e-10 4.892003e-10 ] ] "source-value" [ [ 2.750115 2.05781 3.008489 ] [ 2.459373 1.512643 5.182306 ] [ 3.045421 4.403069 3.012822 ] [ 1.351279 3.64529 4.777489 ] [ 4.685264 1.369475 1.888704 ] [ 3.677702 3.202643 0.9471066 ] [ 3.576002 3.111527 4.892003 ] ] } "instance-id" 1 }