40 Zr 1s n 1 2 2 3 3 3 4 4 4 5 5 5 5 c 1.05899900 -0.44193600 0.23240900 0.25365100 -0.05781600 -0.02788400 -0.04028500 0.00809200 -0.00542800 0.03982000 0.00293200 -0.00236200 0.00110300 z 40.84441900 34.46220500 19.17049100 51.17861100 14.00707100 7.60090800 22.13896600 4.66065100 3.21138300 13.06083400 2.12292000 1.38417100 0.92533800 2s n 1 2 2 3 3 3 4 4 4 5 5 5 5 c 0.34858700 0.11869400 -0.94743000 0.03543400 -0.08973900 -0.00165900 -0.16576600 0.00787200 -0.01142300 -0.00850600 0.00891200 -0.00756900 0.00310900 z 40.66089600 34.55741400 19.24793300 51.37655700 14.00745400 7.60811700 22.06109900 4.66933300 3.21855400 13.07615400 2.12809000 1.38292100 0.92497100 3s n 1 2 2 3 3 3 4 4 4 5 5 5 5 c -0.14735600 -0.08044100 0.52729100 -0.01368200 -0.21181100 -0.82458100 0.20273100 0.01971500 -0.02475600 -0.18814700 0.00763900 0.00666000 0.00152900 z 40.78864600 34.46061200 19.16983600 51.18041400 14.00497000 7.63248500 22.15091100 4.65979400 3.20739300 13.05984500 2.12013500 1.37520400 0.90980300 4s n 1 2 2 3 3 3 4 4 4 5 5 5 5 c 0.05626500 0.03157100 -0.20872400 0.00615400 0.07770300 0.45699700 -0.08185800 -0.64961800 -0.53458300 0.07857900 0.00324400 0.03176800 0.01085600 z 40.78927300 34.46068700 19.16956700 51.17598600 14.00518200 7.62201000 22.13902100 4.70326900 3.21617400 13.06093600 2.12067600 1.37474800 0.90990600 2p n 2 2 3 3 3 3 4 4 4 4 c 0.06927100 0.41874900 0.13632400 0.36907600 -0.19842000 0.17080600 0.16663600 -0.09116300 0.06832000 -0.02621200 z 47.52842300 18.99982200 38.66482400 15.55878700 9.22241300 6.75085400 31.92149700 4.48698700 2.98945500 1.92546200 3p n 2 2 3 3 3 3 4 4 4 4 c -0.00709300 -0.41347200 0.00996500 -0.07933700 0.66087700 0.45984500 -0.00148500 0.03982300 -0.04754400 0.02266500 z 47.29227900 18.93486000 39.08098400 15.57713400 9.22580600 6.74886300 31.47128500 4.46783000 2.96714700 1.89577300 4p n 2 2 3 3 3 3 4 4 4 4 c -0.00032900 -0.16176100 0.00960400 -0.01655300 0.23830100 0.23346100 0.00635500 -0.49095000 -0.59308600 -0.07774700 z 47.28924300 18.91425400 39.06345100 15.57957400 9.19632600 6.74893900 31.48297400 4.46926700 2.98466200 1.88873600 3d n 3 3 3 4 4 4 4 4 c 0.01762200 0.39591700 0.36175600 0.31061000 0.02137500 -0.00506200 0.00138900 0.00193500 z 21.60869600 11.85224700 5.62978200 9.15694600 4.12925100 2.63334300 1.68781800 1.10080100 4d n 3 3 3 4 4 4 4 4 c 0.00396800 0.09560700 0.08675900 0.06692000 -0.19899800 -0.41932000 -0.39465700 -0.17902700 z 21.60435500 11.87380400 5.63272100 9.14442700 4.13391700 2.63388800 1.67464000 1.06464300 5s n 1 2 2 3 3 3 4 4 4 5 5 5 5 c 0.01256300 0.00735300 -0.04620600 0.00085100 0.01890000 0.11484500 -0.02114800 -0.20232500 -0.09431800 0.01254900 0.32567900 0.54673400 0.27353900 z 40.78910700 34.46088300 19.16961300 51.17600100 14.00554300 7.59943100 22.13748900 4.66614800 3.21353000 13.06076600 2.13382500 1.39297300 0.92909900 --------------------------------------------------------------------------------------------------------- 40 Zr4+ 1s n 1 2 2 3 3 3 4 4 4 5 5 5 5 c 1.08374600 -0.68993900 0.63869800 0.25007100 0.11468900 0.04174900 -0.40515900 -0.02405100 0.02626900 -0.04419200 -0.02854400 0.07055100 -0.05256200 z 39.97794800 33.65788300 19.13568700 54.95198100 14.12015400 7.86230100 22.41130400 4.92718900 3.43676700 13.67687900 2.29961300 1.56369700 1.41770100 2s n 1 2 2 3 3 3 4 4 4 5 5 5 5 c 0.37429200 0.09035700 -0.90047600 0.05007000 -0.11562800 -0.06346800 -0.14482300 0.01047100 0.00950300 -0.01428400 -0.00185100 0.00286900 -0.00202500 z 40.66082300 34.55783700 19.25111500 51.37834500 14.00674000 7.60628300 22.05756100 4.66613700 3.21428900 13.08026800 2.12656300 1.37985200 0.92329000 3s n 1 2 2 3 3 3 4 4 4 5 5 5 5 c -0.17625700 -0.07736300 0.56037100 -0.01992300 -0.19506100 -0.77316800 0.20319900 -0.04853300 -0.06992900 -0.18215900 0.02079400 0.00595300 -0.00186200 z 40.78474700 34.46458400 19.17189200 51.18635200 14.00492900 7.64853400 22.14394500 4.65874500 3.20916900 13.06393400 2.12043000 1.37540100 0.90981400 4s n 1 2 2 3 3 3 4 4 4 5 5 5 5 c 0.08166000 0.03904600 -0.27521700 0.00961800 0.09878000 0.52669000 -0.10472600 -0.65935300 -0.51777800 0.10041700 0.01631000 -0.00253000 -0.00992300 z 40.78908100 34.46079600 19.16906000 51.17624900 14.00455400 7.60797200 22.14108600 4.68394700 3.24930900 13.05917800 2.12178700 1.37628100 0.90993200 2p n 2 2 3 3 3 3 4 4 4 4 c 0.06199200 0.45674100 0.11744400 0.33284700 -0.14405900 0.20241000 0.14170700 -0.12661900 0.09911000 -0.03608800 z 47.52185900 18.99664300 38.67962000 15.56844900 9.22040800 6.75633600 31.90212300 4.49112200 2.99574800 1.93636500 3p n 2 2 3 3 3 3 4 4 4 4 c -0.00819900 -0.44399300 0.00929300 -0.08441600 0.62830600 0.44064500 -0.00128700 0.08073300 0.02186000 0.02169500 z 47.29375300 18.93412400 39.08214900 15.57854400 9.24140100 6.73883000 31.47188200 4.46611700 2.96708600 1.89953200 4p n 2 2 3 3 3 3 4 4 4 4 c -0.00658500 -0.19399100 0.00363600 -0.03095100 0.32617600 0.26852800 -0.00806700 -0.52546500 -0.61254500 0.00138200 z 47.28925200 18.91321400 39.06346300 15.57991900 9.19503800 6.75377000 31.48283700 4.45341800 3.01044400 1.89470300 3d n 3 3 3 4 4 4 4 4 c 0.01783600 0.39692800 0.36712300 0.30567100 0.01877400 -0.00757300 0.00629900 0.00515200 z 21.61313800 11.83386400 5.62794900 9.16576700 4.12950200 2.63339000 1.68780600 1.10079900