{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/cohesive-energy-relation-cubic-crystal" "instance-id" 1 "short-name" { "source-value" [ "fcc" ] } "species" { "source-value" [ "Rb" "Rb" "Rb" "Rb" ] } "a" { "source-value" [ 9.07672 8.468547 8.091625 7.817772 7.602556 7.425243 7.27446 7.143291 7.027216 6.923118 6.828753 6.742457 6.662957 6.589261 6.520579 6.456272 6.395815 6.338774 6.284783 6.233533 6.184758 6.13823 6.093752 6.05115 6.022148 5.991624 5.95941 5.925309 5.889084 5.850454 5.809076 5.76453 5.716289 5.663686 5.605852 5.541629 5.469431 5.386991 5.290915 5.175781 5.032109 4.84092 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 9.07672e-10 8.468547e-10 8.091625000000001e-10 7.817772e-10 7.602556000000001e-10 7.425243000000001e-10 7.274460000000001e-10 7.143291e-10 7.027216e-10 6.923118e-10 6.828753e-10 6.742457e-10 6.662956999999999e-10 6.589261e-10 6.520579e-10 6.456272e-10 6.395815e-10 6.338774e-10 6.284783000000001e-10 6.233533e-10 6.184758e-10 6.13823e-10 6.093752e-10 6.05115e-10 6.022148e-10 5.991624e-10 5.95941e-10 5.925309000000001e-10 5.889084000000001e-10 5.850454e-10 5.809076000000001e-10 5.76453e-10 5.716289e-10 5.663686e-10 5.605851999999999e-10 5.541629000000001e-10 5.469431e-10 5.386991e-10 5.290915e-10 5.175781e-10 5.032109e-10 4.840919999999999e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0 0.5 0.5 ] [ 0.5 0 0.5 ] [ 0.5 0.5 0 ] ] } "cohesive-potential-energy" { "source-value" [ 0.63299 0.945813 1.22263 1.47596 1.71132 1.93151 2.13905 2.33437 2.51785 2.69029 2.85154 3.00161 3.14061 3.26865 3.38534 3.49055 3.58413 3.66614 3.73609 3.79376 3.8389 3.87145 3.89151 3.89826 3.89487 3.88343 3.86167 3.82655 3.77399 3.69846 3.5923 3.44467 3.24002 2.95552 2.55505 1.98168 1.14037 -0.138412 -2.17885 -5.67489 -12.3414 -27.5222 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 1.0141617792001922e-19 1.5153594762487105e-19 1.9588692018887042e-19 2.364748605235968e-19 2.741836894707456e-19 3.0946201648414083e-19 3.4271359007222403e-19 3.740073038296896e-19 4.0340404046812805e-19 4.3103197411720324e-19 4.568670721276032e-19 4.809109366759488e-19 5.031811917050689e-19 5.2369546115779205e-19 5.423912601459072e-19 5.59247760373344e-19 5.742409291907904e-19 5.8738037965797125e-19 5.9858760512046725e-19 6.078273576926208e-19 6.150595829589121e-19 6.20274667859616e-19 6.234886341609408e-19 6.245701033799808e-19 6.240269655055297e-19 6.221940754513345e-19 6.187077391244737e-19 6.130808948322241e-19 6.046598545132992e-19 5.925586144963968e-19 5.75549907489984e-19 5.518969740371136e-19 5.191084294924416e-19 4.735265046306816e-19 4.0936413749750405e-19 3.1750013659069446e-19 1.8270741530616962e-19 -2.217604704381696e-20 -3.4909025302300804e-19 -9.092176083611713e-19 -1.977310254794112e-18 -4.4095425392981764e-18 ] } }