Pressure and temperature control of spin-switchable metal-organic coordination polymers from ab initio calculations

Physical Review Letters

Volumn 109, Issue 7, 2012, Pages

  Tarafder, K ^a   Kanungo, S ^b   Oppeneer, P M ^a   Saha Dasgupta, T ^b  

^a UPPSALA UNIVERSITY   (Sweden)

^b S N BOSE NATIONAL CENTRE FOR BASIC SCIENCES   (India)

Author keywords

[No Author keywords available]

Indexed keywords

4-PYRIDINEALDOXIME; AB INITIO CALCULATIONS; AB INITIO MOLECULAR DYNAMICS SIMULATION; COORDINATION POLYMERS; LONG RANGE MAGNETIC ORDERING; LONG RANGE ORDERS; MAGNETIC STATE; METAL ORGANIC FRAMEWORK; METAL-ORGANIC COORDINATION POLYMERS; PRESSURE AND TEMPERATURE; SPIN CROSSOVERS; SPIN STATE; SPIN STATE TRANSITION; TUNABILITIES;

CALCULATIONS; DENSITY FUNCTIONAL THEORY; MANGANESE; MOLECULAR DYNAMICS; NIOBIUM;

ORGANIC POLYMERS;

EID: 84865202485     PISSN: 00319007     EISSN: 10797114     Source Type: Journal    
DOI: 10.1103/PhysRevLett.109.077203     Document Type: Article

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