000000908 001__ 908 000000908 005__ 20240523045438.0 000000908 02470 $$a10.6082/M13776VH$$2doi 000000908 037__ $$aTHESIS$$bDissertation 000000908 041__ $$aeng 000000908 245__ $$aOne-Electron Theories from a Generalized Pauli Exclusion Principle 000000908 260__ $$bUniversity of Chicago 000000908 269__ $$a2017 000000908 300__ $$a83 000000908 336__ $$aDissertation 000000908 502__ $$bPh.D. 000000908 542__ $$fUniversity of Chicago dissertations are covered by copyright. 000000908 590__ $$aThe Pauli Exclusion Principle ensures that orbital occupations arise from a physically real- istic quantum system. There are additional conditions, motivated by quantum information theory, that are necessary for electron occupations to arise out of pure quantum states that are said to generalize the Pauli principle. Our work with Generalized Pauli conditions has lead us to develop electronic structure theories that are able to, i) recover many-body correla- tion energies, ii) derive sufficient conditions for openness in a quantum system, iii) formulate a geometric perspective on energy transfer, and, iv) highlight the structural complexity of excited state spectra, from one-electron theories. 000000908 653__ $$aElectronic Structure 000000908 653__ $$aOpen Quantum Systems 000000908 653__ $$aPauli Exclusion Principle 000000908 653__ $$aQuantum Information Theory 000000908 690__ $$aPhysical Sciences Division 000000908 691__ $$aChemistry 000000908 7001_ $$aChakraborty, Romit$$uUniversity of Chicago 000000908 72012 $$aDavid A. Mazziotti 000000908 8564_ $$9f71067c4-4512-43b5-a697-8e0f29991e7c$$ePublic$$s3108536$$uhttps://knowledge.uchicago.edu/record/908/files/Chakraborty_uchicago_0330D_13903.pdf 000000908 902__ $$ahttp://hdl.handle.net/11417/669 000000908 903__ $$aMade available in DSpace on 2017-10-20T16:58:04Z (GMT). No. of bitstreams: 1 Chakraborty_uchicago_0330D_13903.pdf: 3108536 bytes, checksum: 978c7c2be8005bbdb33ac228f91c7c29 (MD5) Previous issue date: 2017 000000908 909CO $$ooai:knowledge.uchicago.edu:908$$pDissertations$$pGLOBAL_SET$$qthesis_test 000000908 945__ $$aUChicago Dissertations 000000908 945__ $$aPhysical Sciences Division - Dissertations 000000908 946__ $$aUChicago Dissertations 000000908 946__ $$aPhysical Sciences Division 000000908 980__ $$aMIG 000000908 983__ $$aDissertation