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Ìú¸Ëľ³æ (ÖøÃûдÊÖ)
- Ó¦Öú: 158 (¸ßÖÐÉú)
- ½ð±Ò: 5026.1
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- ºì»¨: 26
- Ìû×Ó: 2321
- ÔÚÏß: 7413.5Сʱ
- ³æºÅ: 3123127
- ×¢²á: 2014-04-09
- ÐÔ±ð: GG
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FN Thomson Reuters Web of Science™ VR 1.0 PT J AU Fan, QC Sun, WG Feng, H Zhang, Y Wang, Q AF Fan, Qunchao Sun, Weiguo Feng, Hao Zhang, Yi Wang, Qi TI Analytical potential curves of some hydride molecules using algebraic and energy-consistent method SO EUROPEAN PHYSICAL JOURNAL D LA English DT Article ID DIATOMIC-MOLECULES; ELECTRONIC-STRUCTURE; STATE; MODEL; IONS; SPECTROSCOPY; BE-2; FIT; HF AB Based on the algebraic method (AM) and the energy consistent method (ECM), an AM-ECM protocol for analytical potential energy curves of stable diatomic electronic states is proposed as functions of the internuclear distance. Applications of the AM-ECM to the 6 hydride electronic states of HF-X-1 Sigma(+), DF-X-1 Sigma(+), (DCl)-Cl-35-X-1 Sigma(+), (LiH)-Li-6-X-1 Sigma(+), (LiH)-Li-7-X-1 Sigma(+), and (LiD)-Li-7-X-1 Sigma(+) show that the AM-ECM potentials are in excellent agreement with the experimental RKR data and the full AM-RKR data, and that the AM-ECM can obtain reliable analytical potential energies in the molecular asymptotic and dissociation region for these molecular electronic states. C1 [Fan, Qunchao; Sun, Weiguo; Feng, Hao] Xihua Univ, Res Ctr Adv Computat, Sch Phys & Chem, Chengdu 610039, Peoples R China. [Sun, Weiguo; Zhang, Yi; Wang, Qi] Sichuan Univ, Inst Atom & Mol Phys, Chengdu 610065, Peoples R China. RP Fan, QC (reprint author), Xihua Univ, Res Ctr Adv Computat, Sch Phys & Chem, Chengdu 610039, Peoples R China. EM fanqunchao@sina.com; swg@mail.xhu.edu.cn FU National Natural Science Foundation of China [11204244, 11074204]; Science Foundation of the Chinese Educational Ministry [20100181110085]; Youth Foundation of the Department of Sichuan Science and Technology [2012JQ0055]; Fund of Key Laboratory of Advanced Scientific Computation; Research Fund of Key Disciplines of Atomic and Molecular Physics, Xihua University, People's Republic of China FX This study was supported by the National Natural Science Foundation of China (Grant Nos. 11204244, 11074204), the Science Foundation of the Chinese Educational Ministry (Grant No. 20100181110085), the Youth Foundation (Grant No. 2012JQ0055) of the Department of Sichuan Science and Technology, the Fund of Key Laboratory of Advanced Scientific Computation, and the Research Fund of Key Disciplines of Atomic and Molecular Physics, Xihua University, People's Republic of China. NR 34 TC 0 Z9 0 PU SPRINGER PI NEW YORK PA 233 SPRING ST, NEW YORK, NY 10013 USA SN 1434-6060 EI 1434-6079 J9 EUR PHYS J D JI Eur. Phys. J. D PD JAN 22 PY 2014 VL 68 IS 1 AR 5 DI 10.1140/epjd/e2013-40437-2 PG 6 WC Optics; Physics, Atomic, Molecular & Chemical SC Optics; Physics GA 293TW UT WOS:000329997600005 ER -------------------------------------------------------------------------------- EF |
4Â¥2014-05-16 21:19:19
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Ìú¸Ëľ³æ (ÖøÃûдÊÖ)
- Ó¦Öú: 158 (¸ßÖÐÉú)
- ½ð±Ò: 5026.1
- É¢½ð: 1000
- ºì»¨: 26
- Ìû×Ó: 2321
- ÔÚÏß: 7413.5Сʱ
- ³æºÅ: 3123127
- ×¢²á: 2014-04-09
- ÐÔ±ð: GG
- רҵ: Ô˳ïÓë¹ÜÀí
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FN Thomson Reuters Web of Science™ VR 1.0 PT J AU Fan, QC Wang, Q Sun, WG Li, HD Feng, H AF Fan, Qunchao Wang, Qi Sun, Weiguo Li, Huidong Feng, Hao TI The P-branch emission spectral lines in the [12.8] (2)Phi(7/2)-a(2)Phi(7/2) system of TiCl SO SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY LA English DT Article DE Spectral line; Emission spectrum; Rovibrational transition; TiCl ID ELECTRONIC STATES; SPECTROSCOPY; TIF; REGION; LASER; NM AB The P-branch spectral lines of high-lying rotational quantum states of (2, 1), (1,1) bands in [12.8] (2)Phi(7/2)-a(2)Phi(7/2) electronic transition of TiCl are obtained in this work by using an analytical formula proposed recently by Sun et al. The formula has generated 31 unknown P-branch emission spectral lines up to J = 80.5 those may not be available experimentally for these bands of TiCl molecule. Crown Copyright (C) 2011 Published by Elsevier B.V. All rights reserved. C1 [Fan, Qunchao; Wang, Qi; Sun, Weiguo; Feng, Hao] Xihua Univ, Sch Phys & Chem, Res Ctr Adv Computat, Chengdu 610039, Peoples R China. [Sun, Weiguo; Li, Huidong] Sichuan Univ, Inst Atom & Mol Phys, Chengdu 610065, Peoples R China. RP Sun, WG (reprint author), Xihua Univ, Sch Phys & Chem, Res Ctr Adv Computat, Chengdu 610039, Peoples R China. EM swg@mail.xhu.edu.cn RI Feng, Hao D-1828-2012 Feng, Hao F-8202-2010 FU National Natural Science Foundation of China [11074204]; Science Foundation of the Ministry of Education of China [20100181110085]; Research Fund of Key Disciplines of Atomic and Molecular Physics; Key Laboratory of Advanced Scientific Computation, Xihua University, China FX This study was supported by the National Natural Science Foundation of China (Grant No. 11074204), the Science Foundation of the Ministry of Education of China (Grant No. 20100181110085), the Research Fund of Key Disciplines of Atomic and Molecular Physics, and the Fund of Key Laboratory of Advanced Scientific Computation, Xihua University, China. NR 27 TC 1 Z9 1 PU PERGAMON-ELSEVIER SCIENCE LTD PI OXFORD PA THE BOULEVARD, LANGFORD LANE, KIDLINGTON, OXFORD OX5 1GB, ENGLAND SN 1386-1425 J9 SPECTROCHIM ACTA A JI Spectroc. Acta Pt. A-Molec. Biomolec. Spectr. PD FEB 15 PY 2012 VL 87 BP 199 EP 201 DI 10.1016/j.saa.2011.11.038 PG 3 WC Spectroscopy SC Spectroscopy GA 899JS UT WOS:000300812800026 ER -------------------------------------------------------------------------------- EF |
2Â¥2014-05-16 21:12:27
С·²ÏÂɽ
Ìú¸Ëľ³æ (ÖøÃûдÊÖ)
- Ó¦Öú: 158 (¸ßÖÐÉú)
- ½ð±Ò: 5026.1
- É¢½ð: 1000
- ºì»¨: 26
- Ìû×Ó: 2321
- ÔÚÏß: 7413.5Сʱ
- ³æºÅ: 3123127
- ×¢²á: 2014-04-09
- ÐÔ±ð: GG
- רҵ: Ô˳ïÓë¹ÜÀí
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FN Thomson Reuters Web of Science™ VR 1.0 PT J AU Fan, Q Sun, W Li, H Feng, H AF Fan, Q. Sun, W. Li, H. Feng, H. TI Studies on rovibrational energies in the ground state of nitrogen molecule using an algebraic approach SO INDIAN JOURNAL OF PHYSICS LA English DT Review DE Algebraic method; Diatomic molecule; N-2 molecule; Rovibrational energy ID (1,3)PI(G) RYDBERG STATES; VIBRATIONAL-SPECTRA; O-2; H-2; HD AB An Algebraic Method (AMr) is used to evaluate rotational spectrum constants and energies using a known accurate experimental/theoretical rovibrational energy subset of a given rovibrational band for a diatomic electronic state. The AMr has been applied to study the rovibrational energies up to j = 40 in vibrational bands from v = 0 to 8 of (XI)-I-1 pound (g) (+) electronic state of N-2 molecule. Calculations show that (i) the AMr not only reproduces the accurate experimental/theoretical energies, but also generates rotational constants and the E (vj) 's of high-lying rovibtational excited states; (ii) The accuracies of the rotational spectrum constants and energies are uniquely determined by the quality of the input experimental/theoretical data. C1 [Fan, Q.; Sun, W.; Feng, H.] Xihua Univ, Sch Phys & Chem, Chengdu 610039, Sichuan, Peoples R China. [Fan, Q.; Sun, W.; Feng, H.] Xihua Univ, Res Ctr Adv Computat, Chengdu 610039, Sichuan, Peoples R China. [Sun, W.; Li, H.] Sichuan Univ, Inst Atom & Mol Phys, Chengdu 610065, Sichuan, Peoples R China. RP Sun, W (reprint author), Xihua Univ, Sch Phys & Chem, Chengdu 610039, Sichuan, Peoples R China. EM weiguosun@x263.net FU National Natural Science Foundation of China [11074204]; Department of Science and Technology [2012JQ0055]; Education Department of Sichuan Province, People's Republic of China [12ZA165] FX This study was supported by the National Natural Science Foundation of China (Grant No. 11074204), the Youth Fund (Grant No: 2012JQ0055) of the Department of Science and Technology and the Key Project (Grant No: 12ZA165) of Education Department of Sichuan Province, People's Republic of China. NR 21 TC 2 Z9 2 PU INDIAN ASSOC CULTIVATION SCIENCE PI KOLKATA PA INDIAN J PHYSICS, JADAVPUR, KOLKATA 700 032, INDIA SN 0973-1458 J9 INDIAN J PHYS JI Indian J. Phys. PD APR PY 2012 VL 86 IS 4 BP 237 EP 243 DI 10.1007/s12648-012-0054-x PG 7 WC Physics, Multidisciplinary SC Physics GA 961MF UT WOS:000305467800001 ER -------------------------------------------------------------------------------- EF |
3Â¥2014-05-16 21:14:50
С·²ÏÂɽ
Ìú¸Ëľ³æ (ÖøÃûдÊÖ)
- Ó¦Öú: 158 (¸ßÖÐÉú)
- ½ð±Ò: 5026.1
- É¢½ð: 1000
- ºì»¨: 26
- Ìû×Ó: 2321
- ÔÚÏß: 7413.5Сʱ
- ³æºÅ: 3123127
- ×¢²á: 2014-04-09
- ÐÔ±ð: GG
- רҵ: Ô˳ïÓë¹ÜÀí
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±¬Õ¨Í·1943: ½ð±Ò+20, ¡ï¡ï¡ï¡ï¡ï×î¼Ñ´ð°¸, xixie ! 2014-05-19 20:49:27
±¬Õ¨Í·1943: ½ð±Ò+20, ¡ï¡ï¡ï¡ï¡ï×î¼Ñ´ð°¸, xixie ! 2014-05-19 20:49:27
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FN Thomson Reuters Web of Science™ VR 1.0 PT J AU Fan, QC Sun, WG Li, HD Feng, H AF Fan Qun-Chao Sun Wei-Guo Li Hui-Dong Feng Hao TI P-branch emission spectra of the A(1)Pi-X-1 Sigma(+) system of IrN SO CHINESE PHYSICS B LA English DT Article DE analytical formula; diatomic molecule; IrN; emission spectra ID FOURIER-TRANSFORM; ROTATIONAL ANALYSIS; SPECTROSCOPY; STATE; A(2)PI(U)-X-2-PI(G); BANDS; PBH AB The P-branch emission spectra of (4,1) and (3,1) bands of the A(1)Pi-X-1 Sigma(+) system of IrN molecule are studied using an analytical formula which is derived from elementary expression of molecular total energy by taking multiple spectral differences. It not only reproduces the known experimental transition lines, but also predicts the unknown spectral lines up to J = 80 for each band by using a group of fifteen known experimental transition lines. C1 [Fan Qun-Chao; Sun Wei-Guo; Feng Hao] Xihua Univ, Sch Phys & Chem, Res Ctr Adv Computat, Chengdu 610039, Peoples R China. [Sun Wei-Guo; Li Hui-Dong] Sichuan Univ, Inst Atom & Mol Phys, Chengdu 610065, Peoples R China. RP Sun, WG (reprint author), Xihua Univ, Sch Phys & Chem, Res Ctr Adv Computat, Chengdu 610039, Peoples R China. EM weiguosun@x263.net RI Feng, Hao D-1828-2012 Feng, Hao F-8202-2010 FU National Natural Science Foundation of China [11074204]; Science Foundation of the Ministry of Education of China [20100181110085]; Research Fund of Key Disciplines of Atomic and Molecular Physics; Key Laboratory of Advanced Scientific Computation, Xihua University, China FX Project supported by the National Natural Science Foundation of China (Grant No. 11074204), the Science Foundation of the Ministry of Education of China (Grant No. 20100181110085), the Research Fund of Key Disciplines of Atomic and Molecular Physics, and the Fund of Key Laboratory of Advanced Scientific Computation, Xihua University, China. NR 29 TC 2 Z9 2 PU IOP PUBLISHING LTD PI BRISTOL PA TEMPLE CIRCUS, TEMPLE WAY, BRISTOL BS1 6BE, ENGLAND SN 1674-1056 J9 CHINESE PHYS B JI Chin. Phys. B PD FEB PY 2012 VL 21 IS 2 AR 023301 DI 10.1088/1674-1056/21/2/023301 PG 9 WC Physics, Multidisciplinary SC Physics GA 897GS UT WOS:000300636700033 ER -------------------------------------------------------------------------------- EF |
5Â¥2014-05-16 21:21:34













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