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For example, the PBE1PBE\/6-311G(2d,2p)\/\/PBE1PBE\/6-31+G(d) combination allowed to obtain good results for variety of middle-size organophosphorus compounds (\n                    <italic>M<\/italic>\n                    = 200\u2013700 Da).\n                  <\/p>","DOI":"10.1039\/c5cp00240k","type":"journal-article","created":{"date-parts":[[2015,2,16]],"date-time":"2015-02-16T07:01:37Z","timestamp":1424070097000},"page":"6976-6987","update-policy":"https:\/\/doi.org\/10.1039\/rsc_crossmark_policy","source":"Crossref","is-referenced-by-count":112,"title":["Quantum chemical calculations of\n                    <sup>31<\/sup>\n                    P NMR chemical shifts: scopes and limitations"],"prefix":"10.1039","volume":"17","author":[{"given":"Shamil K.","family":"Latypov","sequence":"first","affiliation":[{"name":"A.E. 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Zh."},{"key":"C5CP00240K-(cit91)\/*[position()=1]","doi-asserted-by":"crossref","first-page":"7561","DOI":"10.1021\/jo000923c","volume":"65","author":"Wang","year":"2000","journal-title":"J. Org. Chem."},{"key":"C5CP00240K-(cit92)\/*[position()=1]","doi-asserted-by":"crossref","first-page":"1223","DOI":"10.1021\/ic801917a","volume":"48","author":"Zhao","year":"2009","journal-title":"Inorg. Chem."},{"key":"C5CP00240K-(cit93)\/*[position()=1]","doi-asserted-by":"crossref","first-page":"382","DOI":"10.1021\/j150647a012","volume":"88","author":"Schmidt","year":"1984","journal-title":"J. Phys. Chem."},{"key":"C5CP00240K-(cit94)\/*[position()=1]","doi-asserted-by":"crossref","first-page":"112","DOI":"10.1063\/1.1418440","volume":"116","author":"Wesolowski","year":"2002","journal-title":"J. Chem. 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Elem."},{"key":"C5CP00240K-(cit100)\/*[position()=1]","doi-asserted-by":"crossref","first-page":"4333","DOI":"10.1016\/S0040-4039(01)95217-7","volume":"45","author":"Richman","year":"1978","journal-title":"Tetrahedron Lett."},{"key":"C5CP00240K-(cit101)\/*[position()=1]","doi-asserted-by":"crossref","first-page":"5298","DOI":"10.1039\/c2ob25532d","volume":"10","author":"Zagidullin","year":"2012","journal-title":"Org. Biomol. Chem."},{"key":"C5CP00240K-(cit103)\/*[position()=1]","doi-asserted-by":"crossref","first-page":"1269","DOI":"10.1002\/ejoc.200801181","author":"Miluykov","year":"2009","journal-title":"Eur. J. Org. 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