Pub Date : 1900-01-01DOI: 10.1007/978-3-030-11714-6_6
M. Gruden, W. Browne, M. Swart, C. Duboc
{"title":"Computational Versus Experimental Spectroscopy for Transition Metals","authors":"M. Gruden, W. Browne, M. Swart, C. Duboc","doi":"10.1007/978-3-030-11714-6_6","DOIUrl":"https://doi.org/10.1007/978-3-030-11714-6_6","url":null,"abstract":"","PeriodicalId":252026,"journal":{"name":"Transition Metals in Coordination Environments","volume":"1 1","pages":"0"},"PeriodicalIF":0.0,"publicationDate":"1900-01-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"130902626","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Pub Date : 1900-01-01DOI: 10.1007/978-3-030-11714-6_17
T. Borowski, M. Szaleniec
{"title":"Challenges in Modelling Metalloenzymes","authors":"T. Borowski, M. Szaleniec","doi":"10.1007/978-3-030-11714-6_17","DOIUrl":"https://doi.org/10.1007/978-3-030-11714-6_17","url":null,"abstract":"","PeriodicalId":252026,"journal":{"name":"Transition Metals in Coordination Environments","volume":"31 1","pages":"0"},"PeriodicalIF":0.0,"publicationDate":"1900-01-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"134463384","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Pub Date : 1900-01-01DOI: 10.1007/978-3-030-11714-6_2
M. Stein
{"title":"Anisotropic Magnetic Spin Interactions of Transition Metal Complexes and Metalloenzymes from Spectroscopy and Quantum Chemistry","authors":"M. Stein","doi":"10.1007/978-3-030-11714-6_2","DOIUrl":"https://doi.org/10.1007/978-3-030-11714-6_2","url":null,"abstract":"","PeriodicalId":252026,"journal":{"name":"Transition Metals in Coordination Environments","volume":"2 1","pages":"0"},"PeriodicalIF":0.0,"publicationDate":"1900-01-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"116680908","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Pub Date : 1900-01-01DOI: 10.1007/978-3-030-11714-6_3
F. Sagan, M. Mitoraj
{"title":"Non-covalent Interactions in Selected Transition Metal Complexes","authors":"F. Sagan, M. Mitoraj","doi":"10.1007/978-3-030-11714-6_3","DOIUrl":"https://doi.org/10.1007/978-3-030-11714-6_3","url":null,"abstract":"","PeriodicalId":252026,"journal":{"name":"Transition Metals in Coordination Environments","volume":"65 1","pages":"0"},"PeriodicalIF":0.0,"publicationDate":"1900-01-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"124850257","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Pub Date : 1900-01-01DOI: 10.1007/978-3-030-11714-6_8
Megan J. Toda, P. Kozlowski, T. Andruniów
{"title":"Assessing Electronically Excited States of Cobalamins via Absorption Spectroscopy and Time-Dependent Density Functional Theory","authors":"Megan J. Toda, P. Kozlowski, T. Andruniów","doi":"10.1007/978-3-030-11714-6_8","DOIUrl":"https://doi.org/10.1007/978-3-030-11714-6_8","url":null,"abstract":"","PeriodicalId":252026,"journal":{"name":"Transition Metals in Coordination Environments","volume":"14 1","pages":"0"},"PeriodicalIF":0.0,"publicationDate":"1900-01-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"130626118","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Pub Date : 1900-01-01DOI: 10.1007/978-3-030-11714-6_1
K. P. Kepp
{"title":"The Electronic Determinants of Spin Crossover Described by Density Functional Theory","authors":"K. P. Kepp","doi":"10.1007/978-3-030-11714-6_1","DOIUrl":"https://doi.org/10.1007/978-3-030-11714-6_1","url":null,"abstract":"","PeriodicalId":252026,"journal":{"name":"Transition Metals in Coordination Environments","volume":"36 1","pages":"0"},"PeriodicalIF":0.0,"publicationDate":"1900-01-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"134245899","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Pub Date : 1900-01-01DOI: 10.1007/978-3-030-11714-6_10
J. Harvey
{"title":"Mechanism and Kinetics in Homogeneous Catalysis: A Computational Viewpoint","authors":"J. Harvey","doi":"10.1007/978-3-030-11714-6_10","DOIUrl":"https://doi.org/10.1007/978-3-030-11714-6_10","url":null,"abstract":"","PeriodicalId":252026,"journal":{"name":"Transition Metals in Coordination Environments","volume":"1 1","pages":"0"},"PeriodicalIF":0.0,"publicationDate":"1900-01-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"122792329","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Pub Date : 1900-01-01DOI: 10.1007/978-3-030-11714-6_12
W. Piskorz, Filip Zasada
{"title":"Catalytic Properties of Selected Transition Metal Oxides—Computational Studies","authors":"W. Piskorz, Filip Zasada","doi":"10.1007/978-3-030-11714-6_12","DOIUrl":"https://doi.org/10.1007/978-3-030-11714-6_12","url":null,"abstract":"","PeriodicalId":252026,"journal":{"name":"Transition Metals in Coordination Environments","volume":"53 1","pages":"0"},"PeriodicalIF":0.0,"publicationDate":"1900-01-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"122549422","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
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