DP code (original) (raw)
DP is a free software package for physicists implementing ab initio linear-response TDDFT (time-dependent density functional theory) in frequency-reciprocal space and on a plane wave basis set. It allows to calculate both dielectric spectra, such as EELS (electron energy-loss spectroscopy), IXSS (inelastic X-ray scattering spectroscopy) and CIXS (coherent inelastic X-ray scattering spectroscopy), and also optical spectra, e.g. optical absorption, reflectivity, refraction index. The systems range from periodic/crystalline solids, to surfaces, clusters, molecules and atoms made of insulators, semiconductors and metal elements. It implements the RPA (random phase approximation), the TDLDA or ALDA (adiabatic local-density approximation) plus other non-local approximations, including or neglect
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| dbo:abstract | DP is a free software package for physicists implementing ab initio linear-response TDDFT (time-dependent density functional theory) in frequency-reciprocal space and on a plane wave basis set. It allows to calculate both dielectric spectra, such as EELS (electron energy-loss spectroscopy), IXSS (inelastic X-ray scattering spectroscopy) and CIXS (coherent inelastic X-ray scattering spectroscopy), and also optical spectra, e.g. optical absorption, reflectivity, refraction index. The systems range from periodic/crystalline solids, to surfaces, clusters, molecules and atoms made of insulators, semiconductors and metal elements. It implements the RPA (random phase approximation), the TDLDA or ALDA (adiabatic local-density approximation) plus other non-local approximations, including or neglecting local-field effects. It is distributed under the scientific software open-source academic for free license. (en) |
| dbo:wikiPageExternalLink | http://www.dp-code.org |
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| dbo:wikiPageRevisionID | 1099087302 (xsd:integer) |
| dbo:wikiPageWikiLink | dbr:EXC_code dbr:Insulator_(electricity) dbr:Time-dependent_density_functional_theory dbr:Molecules dbr:Reflectivity dbr:Cluster_(physics) dbr:Local-density_approximation dbr:Local_field dbr:Random_phase_approximation dbr:Atoms dbr:ABINIT dbc:Computational_chemistry_software dbc:Density_functional_theory_software dbc:Physics_software dbr:Spectroscopy dbr:Metal dbr:Semiconductors dbr:YAMBO_code dbr:Refractive_index dbr:Solid dbr:Plane_wave dbr:Physicist dbr:PWscf dbr:Optical_absorption dbr:Quantum_chemistry_computer_programs dbr:Software_package_(installation) dbr:EELS |
| dbp:wikiPageUsesTemplate | dbt:Chemistry_software dbt:Quantum-chemistry-stub |
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| gold:hypernym | dbr:Package |
| rdf:type | dbo:Software |
| rdfs:comment | DP is a free software package for physicists implementing ab initio linear-response TDDFT (time-dependent density functional theory) in frequency-reciprocal space and on a plane wave basis set. It allows to calculate both dielectric spectra, such as EELS (electron energy-loss spectroscopy), IXSS (inelastic X-ray scattering spectroscopy) and CIXS (coherent inelastic X-ray scattering spectroscopy), and also optical spectra, e.g. optical absorption, reflectivity, refraction index. The systems range from periodic/crystalline solids, to surfaces, clusters, molecules and atoms made of insulators, semiconductors and metal elements. It implements the RPA (random phase approximation), the TDLDA or ALDA (adiabatic local-density approximation) plus other non-local approximations, including or neglect (en) |
| rdfs:label | DP code (en) |
| owl:sameAs | freebase:DP code wikidata:DP code https://global.dbpedia.org/id/4jEuQ |
| prov:wasDerivedFrom | wikipedia-en:DP_code?oldid=1099087302&ns=0 |
| foaf:isPrimaryTopicOf | wikipedia-en:DP_code |
| is dbo:wikiPageWikiLink of | dbr:EXC_code |
| is foaf:primaryTopic of | wikipedia-en:DP_code |