{ "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" [ [ 1.875325 2.956791 1.293332 ] [ 2.112421 5.47429 1.464888 ] [ 2.056962 4.106673 3.914817 ] [ 3.228113 2.011758 3.122182 ] [ 3.602336 4.040974 2.324239 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.875325e-10 2.956791e-10 1.293332e-10 ] [ 2.112421e-10 5.47429e-10 1.464888e-10 ] [ 2.056962e-10 4.106673e-10 3.914817000000001e-10 ] [ 3.228113e-10 2.011758e-10 3.122182e-10 ] [ 3.602336e-10 4.040974e-10 2.324239e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.6510347 -5.9130942 -9.4334206 ] [ -2.9161531 6.3235615 -3.5876894 ] [ -4.8502787 3.5122668 11.1162351 ] [ 1.9201105 -9.2285848 3.4157262 ] [ 12.4973559 5.3058507 -1.5108513 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.065613230046954e-08 -9.473821283828078e-09 -1.511400593949311e-08 ] [ -4.672192319493444e-09 1.013146239549098e-08 -5.748112079371979e-09 ] [ -7.771003137504217e-09 5.627271752972029e-09 1.781017198853635e-08 ] [ 3.076356152452599e-09 -1.478582280963024e-08 5.472596660694025e-09 ] [ 2.002297144479695e-08 8.500909944995314e-09 -2.420650630365287e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -4.0853815 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.545502726348836e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.6428301 2.7906706 1.0822651 ] [ 2.0786032 5.1481068 1.7803004 ] [ 1.7167539 4.1470223 4.0389636 ] [ 3.0714621 2.2880882 3.0674779 ] [ 4.3655077 4.216598 2.150451 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.6428301e-10 2.7906706e-10 1.0822651e-10 ] [ 2.0786032e-10 5.1481068e-10 1.7803004e-10 ] [ 1.7167539e-10 4.1470223e-10 4.0389636e-10 ] [ 3.0714621e-10 2.2880882e-10 3.0674779e-10 ] [ 4.3655077e-10 4.216598000000001e-10 2.150451e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.04e-05 1.11e-05 8e-07 ] [ -9e-07 -1.48e-05 8.7e-06 ] [ -5.2e-06 6e-06 -6e-07 ] [ -4.8e-06 -4.8e-06 3.4e-06 ] [ 5e-07 2.5e-06 -1.23e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.666263685632e-14 1.778416049088e-14 1.28174129664e-15 ] [ -1.44195895872e-15 -2.371221398784e-14 1.393893660096e-14 ] [ -8.33131842816e-15 9.6130597248e-15 -9.6130597248e-16 ] [ -7.69044777984e-15 -7.69044777984e-15 5.44740051072e-15 ] [ 8.010883104e-16 4.005441552e-15 -1.970677243584e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.458486 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.835851837896411e-18 } }