Experimental and computational study of crystalline formic acid composed of the higher-energy conformer

Mikko Hakala, Kseniya Marushkevich, Leonid Khriachtchev, Keijo Hämäläinen, Markku Räsänen

Research output: Contribution to journalArticleScientificpeer-review

Original languageEnglish
JournalJournal of Chemical Physics
Volume134
Issue number5
Pages (from-to)054506
Number of pages7
ISSN0021-9606
DOIs
Publication statusPublished - 2011
MoE publication typeA1 Journal article-refereed

Fields of Science

  • INELASTIC NEUTRON-SCATTERING
  • AUGMENTED-WAVE METHOD
  • AB-INITIO
  • HYDROGEN-BOND
  • INFRARED SPECTRA
  • CIS-HCOOH
  • BASIS-SET
  • SOLIDS
  • STABILIZATION
  • POLYMORPHISM
  • 116 Chemical sciences
  • 114 Physical sciences

Cite this

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title = "Experimental and computational study of crystalline formic acid composed of the higher-energy conformer",
keywords = "INELASTIC NEUTRON-SCATTERING, AUGMENTED-WAVE METHOD, AB-INITIO, HYDROGEN-BOND, INFRARED SPECTRA, CIS-HCOOH, BASIS-SET, SOLIDS, STABILIZATION, POLYMORPHISM, 116 Chemical sciences, 114 Physical sciences",
author = "Mikko Hakala and Kseniya Marushkevich and Leonid Khriachtchev and Keijo H{\"a}m{\"a}l{\"a}inen and Markku R{\"a}s{\"a}nen",
year = "2011",
doi = "10.1063/1.3533955",
language = "English",
volume = "134",
pages = "054506",
journal = "Journal of Chemical Physics",
issn = "0021-9606",
publisher = "AVS",
number = "5",

}

Experimental and computational study of crystalline formic acid composed of the higher-energy conformer. / Hakala, Mikko; Marushkevich, Kseniya; Khriachtchev, Leonid; Hämäläinen, Keijo; Räsänen, Markku.

In: Journal of Chemical Physics, Vol. 134, No. 5, 2011, p. 054506.

Research output: Contribution to journalArticleScientificpeer-review

TY - JOUR

T1 - Experimental and computational study of crystalline formic acid composed of the higher-energy conformer

AU - Hakala, Mikko

AU - Marushkevich, Kseniya

AU - Khriachtchev, Leonid

AU - Hämäläinen, Keijo

AU - Räsänen, Markku

PY - 2011

Y1 - 2011

KW - INELASTIC NEUTRON-SCATTERING

KW - AUGMENTED-WAVE METHOD

KW - AB-INITIO

KW - HYDROGEN-BOND

KW - INFRARED SPECTRA

KW - CIS-HCOOH

KW - BASIS-SET

KW - SOLIDS

KW - STABILIZATION

KW - POLYMORPHISM

KW - 116 Chemical sciences

KW - 114 Physical sciences

U2 - 10.1063/1.3533955

DO - 10.1063/1.3533955

M3 - Article

VL - 134

SP - 054506

JO - Journal of Chemical Physics

JF - Journal of Chemical Physics

SN - 0021-9606

IS - 5

ER -