Magnetic exchange couplings from semilocal functionals evaluated non-self-consistently on hybrid densities: insights on relative importance of exchange, correlation, and delocalization

Juan Ernesto Peralta; Jordan Joshua Phillips

Magnetic exchange couplings from semilocal functionals evaluated non-self-consistently on hybrid densities: insights on relative importance of exchange, correlation, and delocalization

Juan Ernesto Peralta, Jordan Joshua Phillips

Research output: Contribution to journal › Article › peer-review

Original language	English
Pages (from-to)	3147
Journal	Journal of Chemical Theory and Computation
Volume	8
State	Published - 2012

Cite this

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title = "Magnetic exchange couplings from semilocal functionals evaluated non-self-consistently on hybrid densities: insights on relative importance of exchange, correlation, and delocalization",

author = "Peralta, {Juan Ernesto} and Phillips, {Jordan Joshua}",

year = "2012",

language = "English",

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pages = "3147",

journal = "Journal of Chemical Theory and Computation",

issn = "1549-9618",

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Magnetic exchange couplings from semilocal functionals evaluated non-self-consistently on hybrid densities: insights on relative importance of exchange, correlation, and delocalization. / Peralta, Juan Ernesto; Phillips, Jordan Joshua.
In: Journal of Chemical Theory and Computation, Vol. 8, 2012, p. 3147.

Research output: Contribution to journal › Article › peer-review

TY - JOUR

T1 - Magnetic exchange couplings from semilocal functionals evaluated non-self-consistently on hybrid densities: insights on relative importance of exchange, correlation, and delocalization

AU - Peralta, Juan Ernesto

AU - Phillips, Jordan Joshua

PY - 2012

Y1 - 2012

UR - http://dx.doi.org/10.1016/j.cplett.2012.12.013

M3 - Article

SN - 1549-9618

VL - 8

SP - 3147

JO - Journal of Chemical Theory and Computation

JF - Journal of Chemical Theory and Computation

ER -

Magnetic exchange couplings from semilocal functionals evaluated non-self-consistently on hybrid densities: insights on relative importance of exchange, correlation, and delocalization

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