Interaction between the chain and ladder subsystems in (Ca,Sr,La)14Cu24O41 compounds
Creators
- 1. Institut fuer Physik, Universitaet Augsburg, D-86135 Augsburg (Germany)
Description
We investigate the influence of structural modulations on the electronic properties of incommensurate (Ca,Sr,La)14Cu24O41 compounds by band structure calculations based on density functional theory and the local density approximation (LDA). Using a supercell approach with ten CuO2 chain and seven Cu2O3 ladder segments, we take into account the major effects of the structural incommensurability. We find that the LDA electronic states show very little response to these modulations. The coupling between the electronic and structural degrees of freedom, hence, can be well described in terms of two independent subsystems. The incommensurate charge density waves (CDWs) in the chains and the ladders are formed independently of each other. (fast track communication)
Availability note (English)
Available from http://dx.doi.org/10.1088/0953-8984/20/38/382201Additional details
Identifiers
- DOI
- 10.1088/0953-8984/20/38/382201;
- PII
- S0953-8984(08)86194-2;
Publishing Information
- Journal Title
- Journal of Physics. Condensed Matter
- Journal Volume
- 20
- Journal Issue
- 38
- Journal Page Range
- [5 p.]
- ISSN
- 0953-8984
- CODEN
- JCOMEL
INIS
- Country of Publication
- United Kingdom
- Country of Input or Organization
- International Atomic Energy Agency (IAEA)
- INIS RN
- 40035468
- Subject category
- S75: CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND SUPERFLUIDITY;
- Descriptors DEI
- APPROXIMATIONS; CALCIUM COMPOUNDS; CHAINS; CHARGE DENSITY; COPPER COMPOUNDS; COPPER OXIDES; COUPLING; DEGREES OF FREEDOM; DENSITY; DENSITY FUNCTIONAL METHOD; ELECTRICAL PROPERTIES; INTERACTIONS; LANTHANUM COMPOUNDS; MODULATION; OXYGEN COMPOUNDS; SIMULATION; STRONTIUM COMPOUNDS
- Descriptors DEC
- ALKALINE EARTH METAL COMPOUNDS; CALCULATION METHODS; CHALCOGENIDES; COPPER COMPOUNDS; OXIDES; OXYGEN COMPOUNDS; PHYSICAL PROPERTIES; RARE EARTH COMPOUNDS; TRANSITION ELEMENT COMPOUNDS; VARIATIONAL METHODS