Low-dimensional quantum magnetism in : A molecular framework material
- Authors:
- Publication Date:
- Sponsoring Org.:
- USDOE Office of Science (SC), Basic Energy Sciences (BES)
- OSTI Identifier:
- 1434569
- Grant/Contract Number:
- AC02-98CH10886; AC02-06CH11357
- Resource Type:
- Publisher's Accepted Manuscript
- Journal Name:
- Physical Review B
- Additional Journal Information:
- Journal Name: Physical Review B Journal Volume: 97 Journal Issue: 14; Journal ID: ISSN 2469-9950
- Publisher:
- American Physical Society
- Country of Publication:
- United States
- Language:
- English
Citation Formats
Cliffe, Matthew J., Lee, Jeongjae, Paddison, Joseph A. M., Schott, Sam, Mukherjee, Paromita, Gaultois, Michael W., Manuel, Pascal, Sirringhaus, Henning, Dutton, Siân E., and Grey, Clare P. Low-dimensional quantum magnetism in Cu ( NCS ) 2 : A molecular framework material. United States: N. p., 2018.
Web. doi:10.1103/PhysRevB.97.144421.
Cliffe, Matthew J., Lee, Jeongjae, Paddison, Joseph A. M., Schott, Sam, Mukherjee, Paromita, Gaultois, Michael W., Manuel, Pascal, Sirringhaus, Henning, Dutton, Siân E., & Grey, Clare P. Low-dimensional quantum magnetism in Cu ( NCS ) 2 : A molecular framework material. United States. https://doi.org/10.1103/PhysRevB.97.144421
Cliffe, Matthew J., Lee, Jeongjae, Paddison, Joseph A. M., Schott, Sam, Mukherjee, Paromita, Gaultois, Michael W., Manuel, Pascal, Sirringhaus, Henning, Dutton, Siân E., and Grey, Clare P. Wed .
"Low-dimensional quantum magnetism in Cu ( NCS ) 2 : A molecular framework material". United States. https://doi.org/10.1103/PhysRevB.97.144421.
@article{osti_1434569,
title = {Low-dimensional quantum magnetism in Cu ( NCS ) 2 : A molecular framework material},
author = {Cliffe, Matthew J. and Lee, Jeongjae and Paddison, Joseph A. M. and Schott, Sam and Mukherjee, Paromita and Gaultois, Michael W. and Manuel, Pascal and Sirringhaus, Henning and Dutton, Siân E. and Grey, Clare P.},
abstractNote = {},
doi = {10.1103/PhysRevB.97.144421},
journal = {Physical Review B},
number = 14,
volume = 97,
place = {United States},
year = {2018},
month = {4}
}
Free Publicly Available Full Text
Publisher's Version of Record
https://doi.org/10.1103/PhysRevB.97.144421
https://doi.org/10.1103/PhysRevB.97.144421
Other availability
Search WorldCat to find libraries that may hold this journal
Cited by: 2 works
Citation information provided by
Web of Science
Web of Science
Save to My Library
You must Sign In or Create an Account in order to save documents to your library.
Works referenced in this record:
Temperature Dependence of 207 Pb MAS Spectra of Solid Lead Nitrate. An Accurate, Sensitive Thermometer for Variable-Temperature MAS
journal, October 1995
- Bielecki, Anthony; Burum, Douglas P.
- Journal of Magnetic Resonance, Series A, Vol. 116, Issue 2
Generalized Gradient Approximation Made Simple
journal, October 1996
- Perdew, John P.; Burke, Kieron; Ernzerhof, Matthias
- Physical Review Letters, Vol. 77, Issue 18, p. 3865-3868
Correlations, spin dynamics, defects: the highly frustrated kagomé bilayer
journal, August 2005
- Bono, D.; Limot, L.; Mendels, P.
- Low Temperature Physics, Vol. 31, Issue 8
Mantid—Data analysis and visualization package for neutron scattering and SR experiments
journal, November 2014
- Arnold, O.; Bilheux, J. C.; Borreguero, J. M.
- Nuclear Instruments and Methods in Physics Research Section A: Accelerators, Spectrometers, Detectors and Associated Equipment, Vol. 764
Thermodynamics of the Spin- Antiferromagnetic Uniform Heisenberg Chain
journal, May 2000
- Klümper, A.; Johnston, D. C.
- Physical Review Letters, Vol. 84, Issue 20
Magnetic ordering in the frustrated Heisenberg chain system cupric chloride
journal, July 2009
- Banks, M. G.; Kremer, R. K.; Hoch, C.
- Physical Review B, Vol. 80, Issue 2
Structural diversity and magnetic properties of thiocyanate copper(II) complexes
journal, March 2013
- Machura, B.; Świtlicka, A.; Mroziński, J.
- Polyhedron, Vol. 52
Structure cristalline et moléculaire du thiocyanate mercurique
journal, April 1972
- Beauchamp, A. L.; Goutier, D.
- Canadian Journal of Chemistry, Vol. 50, Issue 7
Two-dimensional spin- rectangular Heisenberg antiferromagnets: Simulation and experiment
journal, September 2011
- Keith, B. C.; Landee, C. P.; Valleau, T.
- Physical Review B, Vol. 84, Issue 10
Review: A gentle introduction to magnetism: units, fields, theory, and experiment
journal, February 2014
- Landee, Christopher P.; Turnbull, Mark M.
- Journal of Coordination Chemistry, Vol. 67, Issue 3
Diamagnetic Corrections and Pascal's Constants
journal, April 2008
- Bain, Gordon A.; Berry, John F.
- Journal of Chemical Education, Vol. 85, Issue 4
Synthesis, crystal structure, and magnetic properties of (.mu.-bipyrimidine)(cyanato)copper(II) and -(thiocyanato)copper(II) complexes
journal, March 1993
- Julve, Miguel; Verdaguer, Michel; De Munno, Giovanni
- Inorganic Chemistry, Vol. 32, Issue 6
Dimensionality Selection in a Molecule-Based Magnet
journal, February 2012
- Goddard, Paul A.; Manson, Jamie L.; Singleton, John
- Physical Review Letters, Vol. 108, Issue 7
Specific heat capacity of Apiezon N high vacuum grease and of Duran borosilicate glass
journal, March 1999
- Schnelle, W.; Engelhardt, J.; Gmelin, E.
- Cryogenics, Vol. 39, Issue 3
Observation of the spin-Peierls transition in linear (spin-1/2) chains in an inorganic compound
journal, June 1993
- Hase, Masashi; Terasaki, Ichiro; Uchinokura, Kunimitsu
- Physical Review Letters, Vol. 70, Issue 23
The crystal structure of copper(I) thiocyanate and its relation to the crystal structure of copper(II) diammine dithiocyanate complex
journal, January 1976
- Kabešová, M.; Dunaj-jurčo, M.; Serator, M.
- Inorganica Chimica Acta, Vol. 17
Frustrated Cuprate Route from Antiferromagnetic to Ferromagnetic Spin- Heisenberg Chains: as a Missing Link near the Quantum Critical Point
journal, February 2007
- Drechsler, S. -L.; Volkova, O.; Vasiliev, A. N.
- Physical Review Letters, Vol. 98, Issue 7
Linear antiferromagnetism in copper bromide and copper chloride
journal, January 1964
- Barraclough, C. G.; Ng, C. F.
- Transactions of the Faraday Society, Vol. 60
A room-temperature organometallic magnet based on Prussian blue
journal, December 1995
- Ferlay, S.; Mallah, T.; Ouahès, R.
- Nature, Vol. 378, Issue 6558
Unit-cell refinement from powder diffraction scans
journal, December 1981
- Pawley, G. S.
- Journal of Applied Crystallography, Vol. 14, Issue 6
Electron-energy-loss spectra and the structural stability of nickel oxide: An LSDA+U study
journal, January 1998
- Dudarev, S. L.; Botton, G. A.; Savrasov, S. Y.
- Physical Review B, Vol. 57, Issue 3, p. 1505-1509
Density Functional Theory-Based Bond Pathway Decompositions of Hyperfine Shifts: Equipping Solid-State NMR to Characterize Atomic Environments in Paramagnetic Materials
journal, April 2013
- Middlemiss, Derek S.; Ilott, Andrew J.; Clément, Raphaële J.
- Chemistry of Materials, Vol. 25, Issue 9
[Cu(HF2)(pyz)2]BF4 (pyz = pyrazine): long-range magnetic ordering in a pseudo-cubic coordination polymer comprised of bridging HF2? and pyrazine ligands
journal, January 2006
- Manson, Jamie L.; Conner, Marianne M.; Schlueter, John A.
- Chemical Communications, Issue 47
Spin-flop transition in uniaxial antiferromagnets: Magnetic phases, reorientation effects, and multidomain states
journal, March 2007
- Bogdanov, A. N.; Zhuravlev, A. V.; Rößler, U. K.
- Physical Review B, Vol. 75, Issue 9
A Homoleptic Copper(II)−Thiocyanato Linear Chain
journal, May 1999
- White, Christopher A.; Yap, Glenn P. A.; Raju, N. P.
- Inorganic Chemistry, Vol. 38, Issue 11
Spin order and dynamics in the diamond-lattice Heisenberg antiferromagnets and
journal, August 2017
- Ge, L.; Flynn, J.; Paddison, J. A. M.
- Physical Review B, Vol. 96, Issue 6
Ferroelectric Transition Induced by the Incommensurate Magnetic Ordering in LiCuVO 4
journal, February 2007
- Naito, Yutaka; Sato, Kenji; Yasui, Yukio
- Journal of the Physical Society of Japan, Vol. 76, Issue 2
Spin-Peierls transitions in magnetic donor-acceptor compounds of tetrathiafulvalene (TTF) with bisdithiolene metal complexes
journal, October 1976
- Jacobs, I. S.; Bray, J. W.; Hart, H. R.
- Physical Review B, Vol. 14, Issue 7
The Role of Order–Disorder Transitions in the Quest for Molecular Multiferroics: Structural and Magnetic Neutron Studies of a Mixed Valence Iron(II)–Iron(III) Formate Framework
journal, November 2012
- Cañadillas-Delgado, Laura; Fabelo, Oscar; Rodríguez-Velamazán, J. Alberto
- Journal of the American Chemical Society, Vol. 134, Issue 48
Designing Kitaev Spin Liquids in Metal-Organic Frameworks
journal, August 2017
- Yamada, Masahiko G.; Fujita, Hiroyuki; Oshikawa, Masaki
- Physical Review Letters, Vol. 119, Issue 5
Crystalline, Mixed-Valence Manganese Analogue of Prussian Blue: Magnetic, Spectroscopic, X-ray and Neutron Diffraction Studies
journal, December 2004
- Franz, Patrick; Ambrus, Christina; Hauser, Andreas
- Journal of the American Chemical Society, Vol. 126, Issue 50
Surprises on the Way from One- to Two-Dimensional Quantum Magnets: The Ladder Materials
journal, February 1996
- Dagotto, E.; Rice, T. M.
- Science, Vol. 271, Issue 5249
Antiferromagnetism in a Family of S = 1 Square Lattice Coordination Polymers NiX 2 (pyz) 2 (X = Cl, Br, I, NCS; pyz = Pyrazine)
journal, March 2016
- Liu, Junjie; Goddard, Paul A.; Singleton, John
- Inorganic Chemistry, Vol. 55, Issue 7
Ab initiomolecular dynamics for liquid metals
journal, January 1993
- Kresse, G.; Hafner, J.
- Physical Review B, Vol. 47, Issue 1, p. 558-561
Low-Temperature Properties of Silver
journal, March 1995
- Smith, D. R.; Fickett, F. R.
- Journal of Research of the National Institute of Standards and Technology, Vol. 100, Issue 2
CuBr2 - A New Multiferroic Material with High Critical Temperature
journal, April 2012
- Zhao, Li.; Hung, Tsu-Lien; Li, Ching-Chien
- Advanced Materials, Vol. 24, Issue 18
Fully optimized contracted Gaussian basis sets for atoms Li to Kr
journal, August 1992
- Schäfer, Ansgar; Horn, Hans; Ahlrichs, Reinhart
- The Journal of Chemical Physics, Vol. 97, Issue 4
Magnetic ordering in the rutile molecular magnets Co, Fe, Mn, and
journal, April 2003
- Lappas, Alexandros; Wills, Andrew S.; Green, Mark A.
- Physical Review B, Vol. 67, Issue 14
A 13 C and 15 N nuclear magnetic resonance study of solid ammonium thiocyanate
journal, May 1987
- Dickson, Ross M.; McKinnon, Michael S.; Britten, James F.
- Canadian Journal of Chemistry, Vol. 65, Issue 5
Solid-State 199 Hg MAS NMR Studies of Mercury(II) Thiocyanate Complexes and Related Compounds. Crystal Structure of Hg(SeCN) 2
journal, April 1998
- Bowmaker, Graham A.; Churakov, Andrei V.; Harris, Robin K.
- Inorganic Chemistry, Vol. 37, Issue 8
Fractional spinon excitations in the quantum Heisenberg antiferromagnetic chain
journal, June 2013
- Mourigal, Martin; Enderle, Mechthild; Klöpperpieper, Axel
- Nature Physics, Vol. 9, Issue 7
Structural and magnetic behavior of a quasi-1D antiferromagnetic chain compound Cu(NCS) 2 (pyz)
journal, July 2003
- Bordallo, H. N.; Chapon, L.; Manson, J. L.
- Polyhedron, Vol. 22, Issue 14-17
ISODISPLACE : a web-based tool for exploring structural distortions
journal, July 2006
- Campbell, Branton J.; Stokes, Harold T.; Tanner, David E.
- Journal of Applied Crystallography, Vol. 39, Issue 4
Dynamics of Coupled Quantum Spin Chains
journal, September 1996
- Schulz, H. J.
- Physical Review Letters, Vol. 77, Issue 13
Critical exponents and equation of state of the three-dimensional Heisenberg universality class
journal, April 2002
- Campostrini, Massimo; Hasenbusch, Martin; Pelissetto, Andrea
- Physical Review B, Vol. 65, Issue 14
Thermal rearrangement in copper(II) thiocyanate
journal, January 1969
- Hunter, J. A.; Massie, W. H. S.; Meiklejohn, J.
- Inorganic and Nuclear Chemistry Letters, Vol. 5, Issue 1
Synthesis, crystal structure, magnetic properties and theoretical studies on a one-dimensional polynuclear copper( ii ) complex [Cu 2 (μ 1,3 -SCN) 2 (μ′ 1,3 -SCN) 2 (MPyO) 2 ] n
journal, January 2006
- Shi, Jing-Min; Sun, You-Min; Liu, Zhe
- Dalton Trans., Issue 2
Linear response approach to the calculation of the effective interaction parameters in the method
journal, January 2005
- Cococcioni, Matteo; de Gironcoli, Stefano
- Physical Review B, Vol. 71, Issue 3
Dominant ferromagnetism in the spin-1/2 half-twist ladder 334 compounds, Ba 3 Cu 3 In 4 O 12 and Ba 3 Cu 3 Sc 4 O 12
journal, March 2012
- Dutton, S. E.; Kumar, M.; Soos, Z. G.
- Journal of Physics: Condensed Matter, Vol. 24, Issue 16
Structural, electronic and optical properties of copper, silver and gold sulfide: a DFT study
journal, February 2016
- Suárez, Javier Amaya; Plata, José J.; Márquez, Antonio M.
- Theoretical Chemistry Accounts, Vol. 135, Issue 3
Beiträge zur näheren Kenntniss der Schwefelcyanmetalle
journal, January 1838
- Claus, C.
- Journal für Praktische Chemie, Vol. 15, Issue 1
The spin-½ Heisenberg antiferromagnet on a square lattice and its application to the cuprous oxides
journal, January 1991
- Manousakis, Efstratios
- Reviews of Modern Physics, Vol. 63, Issue 1
Wish: The New Powder and Single Crystal Magnetic Diffractometer on the Second Target Station
journal, April 2011
- Chapon, Laurent C.; Manuel, Pascal; Radaelli, Paolo G.
- Neutron News, Vol. 22, Issue 2
Special points for Brillouin-zone integrations
journal, June 1976
- Monkhorst, Hendrik J.; Pack, James D.
- Physical Review B, Vol. 13, Issue 12, p. 5188-5192
Temperature dependence of the crystal structure of α-AgSCN by powder neutron diffraction
journal, November 2007
- Williams, Darrick J.; Daemen, L. L.; Vogel, S. C.
- Journal of Applied Crystallography, Vol. 40, Issue 6
[N(CH3)4][Mn(N3)3]: A Compound with a Distorted Perovskite Structure through Azido Ligands
journal, January 1996
- Mautner, Franz A.; Cortés, Roberto; Lezama, Luis
- Angewandte Chemie International Edition in English, Vol. 35, Issue 1
Searching beyond Gd for magnetocaloric frameworks: magnetic properties and interactions of the Ln(HCO 2 ) 3 series
journal, January 2015
- Saines, Paul J.; Paddison, Joseph A. M.; Thygesen, Peter M. M.
- Materials Horizons, Vol. 2, Issue 5
Fractional excitations in the square-lattice quantum antiferromagnet
journal, December 2014
- Dalla Piazza, B.; Mourigal, M.; Christensen, N. B.
- Nature Physics, Vol. 11, Issue 1
In situ solid state formation of copper(I) coordination polymers by thermal reduction of copper(II) precursor compounds: structure and reactivity of [Cu(NCS)2(pyrimidine)2]n
journal, January 2009
- Wriedt, Mario; Näther, Christian
- Dalton Transactions, Issue 46
Reduction of Ordered Moment and Néel Temperature of Quasi-One-Dimensional Antiferromagnets and
journal, March 1997
- Kojima, K. M.; Fudamoto, Y.; Larkin, M.
- Physical Review Letters, Vol. 78, Issue 9
Intermediates in thermal decomposition of nickel(II) complexes: The crystal structures of Ni(SCN) 2 (NH 3 ) 2 and Ni(SCN) 2
journal, January 1982
- Dubler, Erich; Reller, Armin; Oswald, H. R.
- Zeitschrift für Kristallographie, Vol. 161, Issue 3-4
Quantum Critical Transition Amplifies Magnetoelastic Coupling in
journal, June 2013
- Brinzari, T. V.; Chen, P.; Sun, Q. -C.
- Physical Review Letters, Vol. 110, Issue 23
L.—The action of water on cupric thiocyanate
journal, January 1916
- Philip, James Charles; Bramley, Arthur
- J. Chem. Soc., Trans., Vol. 109, Issue 0
Quasi-one-dimensional spin chains in CuSiO3: an EPR study
journal, October 2002
- Sichelschmidt, J.; Baenitz, M.; Geibel, C.
- Applied Magnetic Resonance, Vol. 23, Issue 1
Structure and magnetism of coordination polymers containing dicyanamide and tricyanomethanide
journal, November 2003
- Batten, Stuart R.; Murray, Keith S.
- Coordination Chemistry Reviews, Vol. 246, Issue 1-2
Solid-state carbon-13 NMR characterization of the bonding mode of the thiocyanate ion in copper(I) complexes
journal, June 1982
- Zumbulyadis, N.; Gysling, H. J.
- Journal of the American Chemical Society, Vol. 104, Issue 11
A systematic study of 25 Mg NMR in paramagnetic transition metal oxides: applications to Mg-ion battery materials
journal, January 2017
- Lee, Jeongjae; Seymour, Ieuan D.; Pell, Andrew J.
- Physical Chemistry Chemical Physics, Vol. 19, Issue 1
Extended Network Thiocyanate- and Tetracyanoethanide-Based First-Row Transition Metal Complexes
journal, August 2012
- Shurdha, Endrit; Lapidus, Saul H.; Stephens, Peter W.
- Inorganic Chemistry, Vol. 51, Issue 18
First Example of Equatorial−Equatorial Disposition of End-to-End Thiocyanate Bridges in a Polynuclear Copper(II) Complex and Its Relation to the Very Efficient Transmission of the Magnetic Interaction
journal, October 1997
- Navarro, Jorge A. R.; Romero, M. Angustias; Salas, Juan M.
- Inorganic Chemistry, Vol. 36, Issue 22
C RYSTAL14 : A program for the ab initio investigation of crystalline solids
journal, March 2014
- Dovesi, Roberto; Orlando, Roberto; Erba, Alessandro
- International Journal of Quantum Chemistry, Vol. 114, Issue 19
A profile refinement method for nuclear and magnetic structures
journal, June 1969
- Rietveld, H. M.
- Journal of Applied Crystallography, Vol. 2, Issue 2, p. 65-71
EasySpin, a comprehensive software package for spectral simulation and analysis in EPR
journal, January 2006
- Stoll, Stefan; Schweiger, Arthur
- Journal of Magnetic Resonance, Vol. 178, Issue 1, p. 42-55
Pressure-induced enhancement of the magnetic anisotropy in
journal, January 2015
- Quintero, P. A.; Rajan, D.; Peprah, M. K.
- Physical Review B, Vol. 91, Issue 1
Dimethylammonium copper formate [(CH ) NH ]Cu(HCOO) : A metal-organic framework with quasi-one-dimensional antiferromagnetism and magnetostriction
journal, June 2013
- Wang, Zhenxing; Jain, Prashant; Choi, Kwang-Yong
- Physical Review B, Vol. 87, Issue 22
Linking Local Environments and Hyperfine Shifts: A Combined Experimental and Theoretical 31 P and 7 Li Solid-State NMR Study of Paramagnetic Fe(III) Phosphates
journal, December 2010
- Kim, Jongsik; Middlemiss, Derek S.; Chernova, Natasha A.
- Journal of the American Chemical Society, Vol. 132, Issue 47
Über Pseudohalogene (II.): 1. Der Knallsäure-Rest. 2. Das Gleichgewicht zwischen Jod, Selenocyan und den entsprechenden Silbersalzen. 3. Polypseudohalogenide
journal, November 1925
- Birckenbach, Lothar; Kellermann, Karl
- Berichte der deutschen chemischen Gesellschaft (A and B Series), Vol. 58, Issue 10
A Versatile Family of Interconvertible Microporous Chiral Molecular Frameworks: The First Example of Ligand Control of Network Chirality
journal, May 2000
- Kepert, C. J.; Prior, T. J.; Rosseinsky, M. J.
- Journal of the American Chemical Society, Vol. 122, Issue 21
The p-type conduction mechanism in Cu2O: a first principles study
journal, January 2006
- Nolan, Michael; Elliott, Simon D.
- Physical Chemistry Chemical Physics, Vol. 8, Issue 45