{ "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" [ [ 2.735268 2.856882 0.3239211 ] [ 1.752307 5.080999 1.048158 ] [ 2.257155 3.165316 3.087528 ] [ 4.821596 2.368521 1.002197 ] [ 4.597336 2.893151 3.290106 ] [ 3.849033 4.748793 0.5493667 ] [ 3.5339 4.902962 2.909562 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.735268e-10 2.856882e-10 3.239211e-11 ] [ 1.752307e-10 5.080999e-10 1.048158e-10 ] [ 2.257155e-10 3.165316e-10 3.087528e-10 ] [ 4.821596000000001e-10 2.368521e-10 1.002197e-10 ] [ 4.597336e-10 2.893151e-10 3.290106e-10 ] [ 3.849033e-10 4.748793e-10 5.493667e-11 ] [ 3.5339e-10 4.902962e-10 2.909562e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.6176293 -15.5471214 -9.4081588 ] [ -17.5212735 12.2678167 -5.5654516 ] [ -12.5862643 -10.3745382 9.4419842 ] [ 8.3655231 -7.8906035 1.0144169 ] [ 9.3182203 -7.1319191 3.1721998 ] [ 11.8987299 14.1726193 -9.7168412 ] [ 7.1426937 14.5037461 11.0618507 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.060261094958107e-08 -2.490923442781937e-08 -1.507353207413379e-08 ] [ -2.807217476834259e-08 1.965520910499981e-08 -8.916836437713954e-09 ] [ -2.016541840466968e-08 -1.662184255563651e-08 1.512772633920299e-08 ] [ 1.340304553158234e-08 -1.264214045170265e-08 1.625275040924412e-09 ] [ 1.492943471212396e-08 -1.142659404345698e-08 5.082424356066436e-09 ] [ 1.906386686299392e-08 2.270703929795886e-08 -1.556809579866622e-08 ] [ 1.144385685567545e-08 2.323756291543918e-08 1.772303857432012e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 4.0674923 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 6.51684106834402e-19 } "relaxed-configuration-positions" { "source-value" [ [ 3.0145367 1.5777468 0.8288293 ] [ 1.7362914 4.9780482 1.2571114 ] [ 1.8501364 2.9104562 2.3978057 ] [ 4.5025313 3.093325 -0.2177238 ] [ 3.4489106 3.3914708 4.0729714 ] [ 4.0572881 5.1585296 0.8454353 ] [ 4.9369005 4.9070473 3.0264095 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.0145367e-10 1.5777468e-10 8.288293e-11 ] [ 1.7362914e-10 4.9780482e-10 1.2571114e-10 ] [ 1.8501364e-10 2.9104562e-10 2.3978057e-10 ] [ 4.502531300000001e-10 3.093325e-10 -2.177238e-11 ] [ 3.4489106e-10 3.3914708e-10 4.0729714e-10 ] [ 4.0572881e-10 5.1585296e-10 8.454353000000001e-11 ] [ 4.9369005e-10 4.9070473e-10 3.0264095e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4e-07 1.68e-05 1.02e-05 ] [ -9.6e-06 -9.2e-06 -9.3e-06 ] [ 5.26e-05 2.56e-05 -6.9e-06 ] [ -1.88e-05 -7.7e-06 2e-06 ] [ -1.17e-05 -6.5e-06 -2.46e-05 ] [ -1.45e-05 -1.45e-05 1.7e-06 ] [ 2.5e-06 -4.5e-06 2.68e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.408706483200001e-16 2.691656722944e-14 1.634220153216e-14 ] [ -1.538089555968e-14 -1.474002491136e-14 -1.490024257344e-14 ] [ 8.427449025408001e-14 4.101572149248001e-14 -1.105501868352e-14 ] [ -3.012092047104e-14 -1.233675998016e-14 3.2043532416e-15 ] [ -1.874546646336e-14 -1.04141480352e-14 -3.941354487168e-14 ] [ -2.32315610016e-14 -2.32315610016e-14 2.72370025536e-15 ] [ 4.005441552e-15 -7.2097947936e-15 4.293833343744e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.037353 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.889902527771674e-18 } }