Chemical Physics Letters

1

The separation of overlapping transitions in -carotene with broadband 2D electronic spectroscopy

Tessa R. Calhoun, Jeffrey A. Davis, Matthew W. Graham, Graham R. Fleming

Journal:

Année:

2012

Langue:

english

Fichier:

PDF, 633 KB

english, 2012

2

Modulations in restricted amide rotation by steric induced conformational trapping

V.V. Krishnan, William B. Thompson, Joy J. Goto, Kalyani Maitra, Santanu Maitra

Journal:

Chemical Physics Letters

Année:

2012

Langue:

english

Fichier:

PDF, 737 KB

english, 2012

3

Electronic transmutation: Boron acquiring an extra electron becomes ‘carbon’

Jared K. Olson, Alexander I. Boldyrev

Journal:

Chemical Physics Letters

Année:

2012

Langue:

english

Fichier:

PDF, 409 KB

english, 2012

4

Tantalum atom reactions with ammonia: Matrix infrared spectra and DFT calculations of the H2TaNH and H2Ta(NH2)2 molecules

Xing Liu, Xuefeng Wang, Bing Xu, Lester Andrews

Journal:

Chemical Physics Letters

Année:

2012

Langue:

english

Fichier:

PDF, 500 KB

english, 2012

5

Laser heating effect on Raman spectra of styrene–butadiene rubber/multiwalled carbon nanotube nanocomposites

Xinlei Yan, Yasutaka Kitahama, Harumi Sato, Toshiaki Suzuki, Xiaoxia Han, Tamitake Itoh, Liliane Bokobza, Yukihiro Ozaki

Journal:

Chemical Physics Letters

Année:

2012

Langue:

english

Fichier:

PDF, 669 KB

english, 2012

6

Thermal chemiluminescence spectroscopy of amino acids and its salts using a multichannel Fourier-transform spectrometer

Taishi Yamada, Taketo Karakisawa, Masahiko Sekine, Hiroshi Ishii, Chikahiro Satoh, Keith R. Millington, Munetaka Nakata

Journal:

Chemical Physics Letters

Année:

2012

Langue:

english

Fichier:

PDF, 1.81 MB

english, 2012

7

Remarkable hydrogen bonding in the radical anions of guanine–cytosine and adenine–thymine

Bin Peng, Shane R. McNew, Qian-Shu Li, Yaoming Xie, Henry F. Schaefer III

Journal:

Chemical Physics Letters

Année:

2012

Langue:

english

Fichier:

PDF, 1.15 MB

english, 2012

8

Development of the four-body corrected fragment molecular orbital (FMO4) method

Tatsuya Nakano, Yuji Mochizuki, Katsumi Yamashita, Chiduru Watanabe, Kaori Fukuzawa, Katsunori Segawa, Yoshio Okiyama, Takayuki Tsukamoto, Shigenori Tanaka

Journal:

Chemical Physics Letters

Année:

2012

Langue:

english

Fichier:

PDF, 474 KB

english, 2012

9

NMR characterization of substituent effects in cation–π interactions

Fareed Bhasha Sayyed, Cherumuttathu H. Suresh

Journal:

Chemical Physics Letters

Année:

2012

Langue:

english

Fichier:

PDF, 448 KB

english, 2012

10

Comparison of rotationally inelastic rate constants for + Ne measured using pulsed and cw lasers

M. Rosenberry, R. Marhatta, B. Stewart

Journal:

Chemical Physics Letters

Année:

2012

Langue:

english

Fichier:

PDF, 325 KB

english, 2012

11

Theoretical study of intermolecular magnetic interaction of chromium(V)–nitrido complex self-assembly with tetradentate Schiff base ligand

Naoki Matsuoka, Naoki Yoshioka

Journal:

Chemical Physics Letters

Année:

2012

Langue:

english

Fichier:

PDF, 419 KB

english, 2012

12

General formula for accurate calculation of halofullerenes polarizability

D.Sh. Sabirov, R.R. Garipova, R.G. Bulgakov

Journal:

Chemical Physics Letters

Année:

2012

Langue:

english

Fichier:

PDF, 485 KB

english, 2012

13

The hydrogen-bridged radical cation [NH2CO⋯H⋯OCHCH3]+ and its dissociation by proton-transport catalysis

Karl J. Jobst, Johan K. Terlouw

Journal:

Chemical Physics Letters

Année:

2012

Langue:

english

Fichier:

PDF, 345 KB

english, 2012

14

Tunable band gap and magnetism in C2x-(BN)y sheets and ribbons

Chun Tang, Liangzhi Kou, Changfeng Chen

Journal:

Chemical Physics Letters

Année:

2012

Langue:

english

Fichier:

PDF, 1.39 MB

english, 2012

15

Unconventional ionic hydrogen bonds: CH+⋯π (CC) binding energies and structures of benzene+(acetylene)1–4 clusters

Abdel-Rahman Soliman, Ahmed M. Hamid, Samuel A. Abrash, M. Samy El-Shall

Journal:

Chemical Physics Letters

Année:

2012

Langue:

english

Fichier:

PDF, 655 KB

english, 2012

16

O-atom exchange in O(3P) + H2O(1A1) collisions

Matthew Braunstein, Patrick F. Conforti

Journal:

Chemical Physics Letters

Année:

2012

Langue:

english

Fichier:

PDF, 717 KB

english, 2012

17

Theoretical study on microhydration of : On the number of water molecules necessary to stabilize the dianion

Arup Kumar Pathak

Journal:

Chemical Physics Letters

Année:

2012

Langue:

english

Fichier:

PDF, 333 KB

english, 2012

18

Electron wave packet modeling of chemical bonding: Floating and breathing minimal packets with perfect-pairing valence-bond spin coupling

Koji Ando

Journal:

Chemical Physics Letters

Année:

2012

Langue:

english

Fichier:

PDF, 415 KB

english, 2012

19

A theoretical contribution characterizing a potentially new molecular species: MgAs

Ana Paula de Lima Batista, Fernando R. Ornellas

Journal:

Chemical Physics Letters

Année:

2012

Langue:

english

Fichier:

PDF, 356 KB

english, 2012

20

The Yang–Yang anomaly in liquid–liquid criticality: Experimental evidence from adiabatic scanning calorimetry

Patricia Losada-Pérez, Chandra Shekhar Pati Tripathi, Jan Leys, Claudio A. Cerdeiriña, Christ Glorieux, Jan Thoen

Journal:

Chemical Physics Letters

Année:

2012

Langue:

english

Fichier:

PDF, 945 KB

english, 2012

21

Geometric phase and parity-violating energy difference locking of chiral molecules

H.C. Peñate-Rodríguez, P. Bargueño, S. Miret-Artés

Journal:

Chemical Physics Letters

Année:

2012

Langue:

english

Fichier:

PDF, 623 KB

english, 2012

22

Ultrafast third-order nonlinear optical properties of graphene in aqueous solution and polyvinyl alcohol film

Saisai Chu, Shufeng Wang, Qihuang Gong

Journal:

Chemical Physics Letters

Année:

2012

Langue:

english

Fichier:

PDF, 304 KB

english, 2012

23

Phase recognition by lattice phonon Raman spectra: The triclinic structure of the organic semiconductor dibenzo-tetrathiafulvalene

Aldo Brillante, Ivano Bilotti, Raffaele Guido Della Valle, Elisabetta Venuti, Marta Mas-Torrent, Concepció Rovira, Yoshiro Yamashita

Journal:

Chemical Physics Letters

Année:

2012

Langue:

english

Fichier:

PDF, 473 KB

english, 2012

24

Formation dynamics of FeN thin films on Cu(100)

Dodi Heryadi, Udo Schwingenschlögl

Journal:

Chemical Physics Letters

Année:

2012

Langue:

english

Fichier:

PDF, 1.19 MB

english, 2012

25

Isomer-resolved dissociation of small carbon cluster cations, C7+–C10+

Kiichirou Koyasu, Tomohiro Ohtaki, Noriaki Hori, Fuminori Misaizu

Journal:

Chemical Physics Letters

Année:

2012

Langue:

english

Fichier:

PDF, 493 KB

english, 2012

26

Tuned long-range corrected density functional theory method for evaluating the second hyperpolarizabilities of open-shell singlet metal–metal bonded systems

Hitoshi Fukui, Yudai Inoue, Ryohei Kishi, Yasuteru Shigeta, Benoît Champagne, Masayoshi Nakano

Journal:

Chemical Physics Letters

Année:

2012

Langue:

english

Fichier:

PDF, 376 KB

english, 2012

27

Revealing oxidation kinetics of dielectric-embedded Ag nanoparticles via in situ optical microspectroscopy

J.A. Jiménez, M. Sendova, K. McAlpine

Journal:

Chemical Physics Letters

Année:

2012

Langue:

english

Fichier:

PDF, 592 KB

english, 2012

28

Fast protocol for equilibration of entangled and branched polymer chains

Yelena R. Sliozberg, Jan W. Andzelm

Journal:

Chemical Physics Letters

Année:

2012

Langue:

english

Fichier:

PDF, 500 KB

english, 2012

29

Evans hole in internal modes IR spectrum of ions in (NH4)3WO3F3 crystal

Ju.V. Gerasimova, A.N. Vtyurin

Journal:

Chemical Physics Letters

Année:

2012

Langue:

english

Fichier:

PDF, 614 KB

english, 2012

30

Editorial Board

Journal:

Chemical Physics Letters

Année:

2012

Fichier:

PDF, 33 KB

2012

31

Volume 523; Issue none

The separation of overlapping transitions in -carotene with broadband 2D electronic spectroscopy

Modulations in restricted amide rotation by steric induced conformational trapping

Electronic transmutation: Boron acquiring an extra electron becomes ‘carbon’

Tantalum atom reactions with ammonia: Matrix infrared spectra and DFT calculations of the H2TaNH and H2Ta(NH2)2 molecules

Laser heating effect on Raman spectra of styrene–butadiene rubber/multiwalled carbon nanotube nanocomposites

Thermal chemiluminescence spectroscopy of amino acids and its salts using a multichannel Fourier-transform spectrometer

Remarkable hydrogen bonding in the radical anions of guanine–cytosine and adenine–thymine

Development of the four-body corrected fragment molecular orbital (FMO4) method

NMR characterization of substituent effects in cation–π interactions

Comparison of rotationally inelastic rate constants for + Ne measured using pulsed and cw lasers

Theoretical study of intermolecular magnetic interaction of chromium(V)–nitrido complex self-assembly with tetradentate Schiff base ligand

General formula for accurate calculation of halofullerenes polarizability

The hydrogen-bridged radical cation [NH2CO⋯H⋯OCHCH3]+ and its dissociation by proton-transport catalysis

Tunable band gap and magnetism in C2x-(BN)y sheets and ribbons

Unconventional ionic hydrogen bonds: CH+⋯π (CC) binding energies and structures of benzene+(acetylene)1–4 clusters

O-atom exchange in O(3P) + H2O(1A1) collisions

Theoretical study on microhydration of : On the number of water molecules necessary to stabilize the dianion

Electron wave packet modeling of chemical bonding: Floating and breathing minimal packets with perfect-pairing valence-bond spin coupling

A theoretical contribution characterizing a potentially new molecular species: MgAs

The Yang–Yang anomaly in liquid–liquid criticality: Experimental evidence from adiabatic scanning calorimetry

Geometric phase and parity-violating energy difference locking of chiral molecules

Ultrafast third-order nonlinear optical properties of graphene in aqueous solution and polyvinyl alcohol film

Phase recognition by lattice phonon Raman spectra: The triclinic structure of the organic semiconductor dibenzo-tetrathiafulvalene

Formation dynamics of FeN thin films on Cu(100)

Isomer-resolved dissociation of small carbon cluster cations, C7+–C10+

Tuned long-range corrected density functional theory method for evaluating the second hyperpolarizabilities of open-shell singlet metal–metal bonded systems

Revealing oxidation kinetics of dielectric-embedded Ag nanoparticles via in situ optical microspectroscopy

Fast protocol for equilibration of entangled and branched polymer chains

Evans hole in internal modes IR spectrum of ions in (NH4)3WO3F3 crystal

Editorial Board

Contents