Sökning: onr:"swepub:oai:DiVA.org:mau-2280" > Interpretation of v...
Fältnamn | Indikatorer | Metadata |
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000 | 03417naa a2200505 4500 | |
001 | oai:DiVA.org:mau-2280 | |
003 | SwePub | |
008 | 200227s2014 | |||||||||||000 ||eng| | |
009 | oai:research.chalmers.se:85b7f70d-4c05-4025-aed1-1221bae2d706 | |
024 | 7 | a https://urn.kb.se/resolve?urn=urn:nbn:se:mau:diva-22802 URI |
024 | 7 | a https://doi.org/10.1103/PhysRevB.90.0751482 DOI |
024 | 7 | a https://research.chalmers.se/publication/2033722 URI |
040 | a (SwePub)maud (SwePub)cth | |
041 | a engb eng | |
042 | 9 SwePub | |
072 | 7 | a ref2 swepub-contenttype |
072 | 7 | a art2 swepub-publicationtype |
100 | 1 | a Hyldgaard, Per,d 1964u Malmö högskola,Institutionen för materialvetenskap och tillämpad matematik (MTM),Chalmers tekniska högskola,Chalmers University of Technology4 aut0 (Swepub:cth)hyldgaar |
245 | 1 0 | a Interpretation of van der Waals density functionals |
264 | 1 | b American Physical Society,c 2014 |
338 | a electronic2 rdacarrier | |
520 | a The nonlocal correlation energy in the van der Waals density functional (vdW-DF) method can be interpreted in terms of a coupling of zero-point energies of characteristic modes of semilocal exchange-correlation (xc) holes. These xc holes reflect the internal functional in the framework of the vdW-DF method. We explore the internal xc hole components, showing that they share properties with those of the generalized-gradient approximation. We use these results to illustrate the nonlocality in the vdW-DF description and analyze the vdW-DF formulation of nonlocal correlation. | |
650 | 7 | a NATURVETENSKAPx Fysik0 (SwePub)1032 hsv//swe |
650 | 7 | a NATURAL SCIENCESx Physical Sciences0 (SwePub)1032 hsv//eng |
650 | 7 | a NATURVETENSKAPx Kemix Teoretisk kemi0 (SwePub)104072 hsv//swe |
650 | 7 | a NATURAL SCIENCESx Chemical Sciencesx Theoretical Chemistry0 (SwePub)104072 hsv//eng |
650 | 7 | a TEKNIK OCH TEKNOLOGIERx Nanoteknik0 (SwePub)2102 hsv//swe |
650 | 7 | a ENGINEERING AND TECHNOLOGYx Nano-technology0 (SwePub)2102 hsv//eng |
650 | 7 | a NATURVETENSKAPx Fysikx Den kondenserade materiens fysik0 (SwePub)103042 hsv//swe |
650 | 7 | a NATURAL SCIENCESx Physical Sciencesx Condensed Matter Physics0 (SwePub)103042 hsv//eng |
653 | a van der Waals forces | |
653 | a Quantum Chemistry | |
653 | a Density Functional Theory | |
653 | a vdW-DF | |
653 | a Sparse matter interactions | |
700 | 1 | a Berland, Kristian,d 1983u Chalmers tekniska högskola,Chalmers University of Technology4 aut0 (Swepub:cth)berland |
700 | 1 | a Schröder, Elsebeth,d 1966u Chalmers tekniska högskola,Chalmers University of Technology4 aut0 (Swepub:cth)schroder |
710 | 2 | a Malmö högskolab Institutionen för materialvetenskap och tillämpad matematik (MTM)4 org |
773 | 0 | t Physical Review B. Condensed Matter and Materials Physicsd : American Physical Societyg 90:7q 90:7x 1098-0121x 1550-235Xx 2469-9950x 2469-9969 |
856 | 4 | u http://arxiv.org/pdf/1408.2075v1 |
856 | 4 | u https://mau.diva-portal.org/smash/get/diva2:1399033/FULLTEXT01.pdfx primaryx Raw objecty fulltext:postprint |
856 | 4 | u http://publications.lib.chalmers.se/records/fulltext/203372/local_203372.pdfx primaryx freey FULLTEXT |
856 | 4 8 | u https://urn.kb.se/resolve?urn=urn:nbn:se:mau:diva-2280 |
856 | 4 8 | u https://doi.org/10.1103/PhysRevB.90.075148 |
856 | 4 8 | u https://research.chalmers.se/publication/203372 |
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