Correction: Orbital entanglement and CASSCF analysis of the Ru–NO bond in a Ruthenium nitrosyl complex

Literature Information

Publication Date 2015-05-01
DOI 10.1039/C5CP90073E
Impact Factor 3.676
Authors

Leon Freitag, Stefan Knecht, Sebastian F. Keller, Mickaël G. Delcey, Thomas Bondon Pedersen, Roland Lindh, Markus Reiher, Leticia Gonzalez


View Original

Abstract

Correction for ‘Orbital entanglement and CASSCF analysis of the Ru–NO bond in a Ruthenium nitrosyl complex’ by Leon Freitag et al., Phys. Chem. Chem. Phys., 2015, DOI: 10.1039/c4cp05278a.

Related Literature

Singlet excitation in the intermediate magnetic equivalence regime and field-dependent study of singlet–triplet leakage

Boris Kharkov, Xueyou Duan, Emily S. Tovar, James W. Canary, Alexej Jerschow

2019-01-10 Paper

DOI: 10.1039/C8CP06883F

Origin band of the first photoionizing transition of hydrogen isocyanide

Bérenger Gans, Gustavo A. Garcia, Séverine Boyé-Péronne, Stephen T. Pratt, Jean-Claude Guillemin, Alfredo Aguado, Octavio Roncero, Jean-Christophe Loison

2019-01-10 Paper

DOI: 10.1039/C8CP07737A

Micromechanical exfoliation of graphene on the atomistic scale‡

Robert C. Sinclair, James L. Suter, Peter V. Coveney

2019-02-25 Paper

DOI: 10.1039/C8CP07796G

Computational microscopy study of the granular structure and pH dependence of PEDOT:PSS

Mohsen Modarresi, Igor Zozoulenko

2019-03-04 Paper

DOI: 10.1039/C8CP07141A

Tritium trapping and migration mechanisms in Li2O: a first-principles study

Xin Xiang, Guikai Zhang, Feilong Yang, Tao Tang

2019-02-13 Paper

DOI: 10.1039/C8CP07187J

Inside front cover

Cover

DOI: 10.1039/C9CP90038A

Ab initio calculations and reduced density gradient analyses of the structure and energetics of hydrated calcium fluoride and calcium carbonate

Isabel del Carmen Sáenz-Tavera, Victor M. Rosas-García

2019-02-13 Paper

DOI: 10.1039/C8CP06353B

Theoretical predication of the high hydrogen evolution catalytic activity for the cubic and tetragonal SnP systems

Jingwei Liu, Guangtao Yu, Ran Zhang, Xuri Huang, Wei Chen

2019-02-08 Paper

DOI: 10.1039/C9CP00618D

Building intermixed donor–acceptor architectures for water-processable organic photovoltaics

Melissa Marks, Natalie P. Holmes, Xun Pan, Riku Chowdhury, Matthew G. Barr, Coralie Fenn, Matthew J. Griffith, A. L. David Kilcoyne, David A. Lewis, Mats R. Andersson, Warwick J. Belcher, Paul C. Dastoor

2019-02-19 Paper

DOI: 10.1039/C8CP07137C

You might also like

Compound Q&A

What are the main uses of 4-Nitrophenyl phosphate disodium salt hexahydrate (CAS: 333338-18-4)?

4-Nitrophenyl phosphate disodium salt hexahydrate is primarily used as a substra...

333338-18-44-Nitrophenyl phosph...
Compound Q&A

What are the main uses of 2-(Trifluoromethyl)-1,3-oxazole-4-carboxylic Acid (CAS: 1060816-01-4)?

2-(Trifluoromethyl)-1,3-oxazole-4-carboxylic Acid (CAS: 1060816-01-4) is widely ...

1060816-01-42-(Trifluoromethyl)-...
Compound Q&A

How should 2-Fluoro-4-biphenylcarboxylic acid (CAS: 137045-30-8) be stored?

2-Fluoro-4-biphenylcarboxylic acid should be stored in a cool, dry place at room...

137045-30-82-Fluoro-4-biphenylc...
Compound Q&A

What industries use Prednisolone-21-Carboxylic Acid (CAS: 61549-70-0)?

Prednisolone-21-Carboxylic Acid is primarily used in the pharmaceutical industry...

61549-70-0Prednisolone-21-Carb...
Compound Q&A

How should 4-(Hydrazinomethyl)-1,2,3-benzenetriol (CAS: 3614-72-0) be stored?

4-(Hydrazinomethyl)-1,2,3-benzenetriol (CAS: 3614-72-0) should be stored in a co...

3614-72-04-(Hydrazinomethyl)-...
Compound Q&A

What industries use 4-Amino-1-methyl-1H-pyrazole-5-carboxylic acid hydrochloride (CAS: 92534-70-8)?

4-Amino-1-methyl-1H-pyrazole-5-carboxylic acid hydrochloride (CAS: 92534-70-8) i...

92534-70-84-Amino-1-methyl-1H-...
Compound Q&A

What regulatory guidelines apply to dehydropachymic acid (CAS: 77012-31-8)?

Dehydropachymic acid (CAS: 77012-31-8) is regulated by various agencies. It fall...

77012-31-8Dehydropachymic acid
Compound Q&A

What is the market or research trend for 6-[(2,2-Dimethylpropanoyl)amino]nicotinic acid (CAS: 898561-66-5)?

The market and research trends for 6-[(2,2-Dimethylpropanoyl)amino]nicotinic aci...

898561-66-56-[(2,2-Dimethylprop...
Compound Q&A

How should 1,10-Phenanthroline-2,9-dicarbaldehyde (CAS: 57709-62-3) be stored?

1,10-Phenanthroline-2,9-dicarbaldehyde should be stored in a cool, dry place awa...

57709-62-31,10-Phenanthroline-...
Compound Q&A

How is 5-Carbamoyl-11-oxo-10,11-dihydro-5H-dibenzo[b,f]azepin-10-yl acetate (CAS: 113952-21-9) typically synthesized?

5-Carbamoyl-11-oxo-10,11-dihydro-5H-dibenzo[b,f]azepin-10-yl acetate can be synt...

113952-21-95-Carbamoyl-11-oxo-1...

Source Journal

Physical Chemistry Chemical Physics

Physical Chemistry Chemical Physics
CiteScore: 5.5
Self-citation Rate: 10.3%
Articles per Year: 3036

Physical Chemistry Chemical Physics (PCCP) is an international journal co-owned by 19 physical chemistry and physics societies from around the world. This journal publishes original, cutting-edge research in physical chemistry, chemical physics and biophysical chemistry. To be suitable for publication in PCCP, articles must include significant innovation and/or insight into physical chemistry; this is the most important criterion that reviewers and Editors will judge against when evaluating submissions. The journal has a broad scope and welcomes contributions spanning experiment, theory, computation and data science. Topical coverage includes spectroscopy, dynamics, kinetics, statistical mechanics, thermodynamics, electrochemistry, catalysis, surface science, quantum mechanics, quantum computing and machine learning. Interdisciplinary research areas such as polymers and soft matter, materials, nanoscience, energy, surfaces/interfaces, and biophysical chemistry are welcomed if they demonstrate significant innovation and/or insight into physical chemistry. Joined experimental/theoretical studies are particularly appreciated when complementary and based on up-to-date approaches.

Recommended Compounds

Recommended Suppliers

Disclaimer
This page provides academic journal information for reference and research purposes only. We are not affiliated with any journal publishers and do not handle publication submissions. For publication-related inquiries, please contact the respective journal publishers directly.
If you notice any inaccuracies in the information displayed, please contact us at support@chemtradehub.com. We will promptly review and address your concerns.