Class information for:
Level 1: SCALED QUANTUM MECHANICAL FORCE FIELD//CHEM MOLEC SPECT//3 3 DIMETHYL 1 TRIMETHYLGERMYLCYCLOPROPENE

Basic class information
Class id #P Avg. number of
references		 Database coverage
of references
12708 886 35.4 49%


Bar chart of Publication_year

Last years might be incomplete

Hierarchy of classes
The table includes all classes above and classes immediately below the current class.


Cluster id Level Cluster label #P
5 4 CHEMISTRY, ORGANIC//CHEMISTRY, INORGANIC & NUCLEAR//CHEMISTRY, MULTIDISCIPLINARY 1745167
3 3       PHYSICS, ATOMIC, MOLECULAR & CHEMICAL//JOURNAL OF CHEMICAL PHYSICS//CHEMISTRY, PHYSICAL 183883
902 2             PHYSICS, ATOMIC, MOLECULAR & CHEMICAL//CONICAL INTERSECTIONS//CHEMISTRY, PHYSICAL 11280
12708 1                   SCALED QUANTUM MECHANICAL FORCE FIELD//CHEM MOLEC SPECT//3 3 DIMETHYL 1 TRIMETHYLGERMYLCYCLOPROPENE 886

Terms with highest relevance score


rank Term termType Chi square Shr. of publ. in
class containing
term		 Class's shr. of
term's tot. occurrences		 #P with
term in
class
1 SCALED QUANTUM MECHANICAL FORCE FIELD authKW 245286 1% 65% 11
2 CHEM MOLEC SPECT address 200507 1% 73% 8
3 3 3 DIMETHYL 1 TRIMETHYLGERMYLCYCLOPROPENE authKW 137851 0% 100% 4
4 3 3 DIMETHYL 1 TRIMETHYLSILYLCYCLOPROPENE authKW 137851 0% 100% 4
5 3 3 DIMETHYL 1 TRIMETHYLSTANNYLCYCLOPROPENE authKW 137851 0% 100% 4
6 ANALYSIS OF ROTATIONAL STRUCTURE authKW 137851 0% 100% 4
7 EXPERIMENTAL VIBRATIONAL SPECTRUM authKW 137851 0% 100% 4
8 MP2FC AUG CC PVDZ authKW 137851 0% 100% 4
9 QUANTUM MECHANICAL FORCE FIELD authKW 107693 1% 63% 5
10 2 4 DIMETHYL 1 3 PENTADIENE authKW 103388 0% 100% 3

Web of Science journal categories


Rank Term Chi square Shr. of publ. in
class containing
term		 Class's shr. of
term's tot. occurrences		 #P with
term in
class
1 Physics, Atomic, Molecular & Chemical 9977 42% 0% 371
2 Chemistry, Physical 9941 69% 0% 609
3 Spectroscopy 537 7% 0% 65
4 Chemistry, Multidisciplinary 474 17% 0% 154
5 Crystallography 22 2% 0% 18
6 Mathematics, Interdisciplinary Applications 21 2% 0% 14
7 Chemistry, Inorganic & Nuclear 11 2% 0% 21
8 Chemistry, Organic 5 3% 0% 26
9 Imaging Science & Photographic Technology 3 0% 0% 4
10 Optics -0 2% 0% 14

Address terms


Rank Term Chi square Shr. of publ. in
class containing
term		 Class's shr. of
term's tot. occurrences		 #P with
term in
class
1 CHEM MOLEC SPECT 200507 1% 73% 8
2 MOL STRUCT QUANTUM MECH 101479 2% 16% 18
3 MOL STRUCT QUANT MECH 68926 0% 100% 2
4 SCI CHIM PHYS MOLEC 68926 0% 100% 2
5 SCI CP 160 09 68926 0% 100% 2
6 SERV CHIM QUANT PHOTOPHYS ATOMES MOL ATMOSPHE 50123 0% 36% 4
7 MINIST EDUC MOE CHEM CHEM ENGN 45949 0% 67% 2
8 MOLEC MAT SCI 45949 0% 67% 2
9 MOLEC STRUCT QUANTUM CHEM 45949 0% 67% 2
10 CCS CCM 34463 0% 100% 1

Journals


Rank Term Chi square Shr. of publ. in
class containing
term		 Class's shr. of
term's tot. occurrences		 #P with
term in
class
1 JOURNAL OF CHEMICAL PHYSICS 8460 16% 0% 146
2 JOURNAL OF PHYSICAL CHEMISTRY 6998 8% 0% 71
3 EXCITED STATES 6891 0% 20% 1
4 JOURNAL OF MOLECULAR STRUCTURE 6749 7% 0% 63
5 JOURNAL OF PHYSICAL CHEMISTRY A 3952 7% 0% 59
6 CHEMICAL PHYSICS LETTERS 3732 8% 0% 72
7 VESTNIK MOSKOVSKOGO UNIVERSITETA SERIYA 2 KHIMIYA 2931 1% 1% 13
8 ACTA CHEMICA SCANDINAVICA SERIES A-PHYSICAL AND INORGANIC CHEMISTRY 2863 1% 1% 9
9 JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM 2169 3% 0% 27
10 CHEMICAL PHYSICS 1931 3% 0% 28

Author Key Words


Rank Term Chi square Shr. of publ. in
class containing
term		 Class's shr. of
term's tot. occurrences		 #P with
term in
class		 LCSH search Wikipedia search
1 SCALED QUANTUM MECHANICAL FORCE FIELD 245286 1% 65% 11 Search SCALED+QUANTUM+MECHANICAL+FORCE+FIELD Search SCALED+QUANTUM+MECHANICAL+FORCE+FIELD
2 3 3 DIMETHYL 1 TRIMETHYLGERMYLCYCLOPROPENE 137851 0% 100% 4 Search 3+3+DIMETHYL+1+TRIMETHYLGERMYLCYCLOPROPENE Search 3+3+DIMETHYL+1+TRIMETHYLGERMYLCYCLOPROPENE
3 3 3 DIMETHYL 1 TRIMETHYLSILYLCYCLOPROPENE 137851 0% 100% 4 Search 3+3+DIMETHYL+1+TRIMETHYLSILYLCYCLOPROPENE Search 3+3+DIMETHYL+1+TRIMETHYLSILYLCYCLOPROPENE
4 3 3 DIMETHYL 1 TRIMETHYLSTANNYLCYCLOPROPENE 137851 0% 100% 4 Search 3+3+DIMETHYL+1+TRIMETHYLSTANNYLCYCLOPROPENE Search 3+3+DIMETHYL+1+TRIMETHYLSTANNYLCYCLOPROPENE
5 ANALYSIS OF ROTATIONAL STRUCTURE 137851 0% 100% 4 Search ANALYSIS+OF+ROTATIONAL+STRUCTURE Search ANALYSIS+OF+ROTATIONAL+STRUCTURE
6 EXPERIMENTAL VIBRATIONAL SPECTRUM 137851 0% 100% 4 Search EXPERIMENTAL+VIBRATIONAL+SPECTRUM Search EXPERIMENTAL+VIBRATIONAL+SPECTRUM
7 MP2FC AUG CC PVDZ 137851 0% 100% 4 Search MP2FC+AUG+CC+PVDZ Search MP2FC+AUG+CC+PVDZ
8 QUANTUM MECHANICAL FORCE FIELD 107693 1% 63% 5 Search QUANTUM+MECHANICAL+FORCE+FIELD Search QUANTUM+MECHANICAL+FORCE+FIELD
9 2 4 DIMETHYL 1 3 PENTADIENE 103388 0% 100% 3 Search 2+4+DIMETHYL+1+3+PENTADIENE Search 2+4+DIMETHYL+1+3+PENTADIENE
10 3 3 DIMETHYL 1 2 BISTERT BUTYLCYCLOPROPENE 103388 0% 100% 3 Search 3+3+DIMETHYL+1+2+BISTERT+BUTYLCYCLOPROPENE Search 3+3+DIMETHYL+1+2+BISTERT+BUTYLCYCLOPROPENE

Core articles
The table includes core articles in the class. The following variables is taken into account for the relevance score of an article in a cluster c:
(1) Number of references referring to publications in the class.
(2) Share of total number of active references referring to publications in the class.
(3) Age of the article. New articles get higher score than old articles.
(4) Citation rate, normalized to year.


Rank Reference # ref.
in cl.		 Shr. of ref. in
cl.		 Citations
1 PANCHENKO, YN , DE MARE, GR , (2008) VIBRATIONAL ANALYSIS OF BUTA-1,3-DIENE AND ITS DEUTERO AND C-13 DERIVATIVES AND SOME OF THEIR ROTATIONAL ISOMERS.JOURNAL OF STRUCTURAL CHEMISTRY. VOL. 49. ISSUE 2. P. 235 -244 45 87% 11
2 ARRUDA, BC , SENSION, RJ , (2014) ULTRAFAST POLYENE DYNAMICS: THE RING OPENING OF 1,3-CYCLOHEXADIENE DERIVATIVES.PHYSICAL CHEMISTRY CHEMICAL PHYSICS. VOL. 16. ISSUE 10. P. 4439 -4455 57 44% 21
3 ORLANDI, G , ZERBETTO, F , ZGIERSKI, MZ , (1991) THEORETICAL-ANALYSIS OF SPECTRA OF SHORT POLYENES.CHEMICAL REVIEWS. VOL. 91. ISSUE 5. P. 867 -891 77 58% 236
4 BOGGIO-PASQUA, M , BEARPARK, MJ , KLENE, M , ROBB, MA , (2004) A COMPUTATIONAL STRATEGY FOR GEOMETRY OPTIMIZATION OF IONIC AND COVALENT EXCITED STATES, APPLIED TO BUTADIENE AND HEXATRIENE.JOURNAL OF CHEMICAL PHYSICS. VOL. 120. ISSUE 17. P. 7849 -7860 46 74% 42
5 DEB, S , WEBER, PM , (2011) THE ULTRAFAST PATHWAY OF PHOTON-INDUCED ELECTROCYCLIC RING-OPENING REACTIONS: THE CASE OF 1,3-CYCLOHEXADIENE.ANNUAL REVIEW OF PHYSICAL CHEMISTRY, VOL 62. VOL. 62. ISSUE . P. 19-39 34 68% 41
6 WOYWOD, C , LIVINGOOD, WC , FREDERICK, JH , (2001) S-1-S-2 VIBRONIC COUPLING IN CIS-1,3,5-HEXATRIENE. II. THEORETICAL INVESTIGATION OF ABSORPTION AND RESONANCE RAMAN SPECTRA.JOURNAL OF CHEMICAL PHYSICS. VOL. 114. ISSUE 4. P. 1645-1662 44 79% 11
7 PANCHENKO, YN , BOCK, CW , ABRAMENKOV, AV , LARKIN, JD , (2009) IDENTIFICATION OF THE HIGH-ENERGY CONFORMER OF OCTA-1,3,5,7-TETRAENE DETECTED IN THE ONE-PHOTON EXCITATION FLUORESCENCE SPECTRUM.STRUCTURAL CHEMISTRY. VOL. 20. ISSUE 6. P. 983 -993 34 81% 3
8 PANCHENKO, YN , AUWERA, JV , MOUSSAOUI, Y , DE MARE, GR , (2003) PREDICTIVE ABILITIES OF SCALED QUANTUM MECHANICAL MOLECULAR FORCE FIELDS: APPLICATION TO 1,3-BUTADIENE.STRUCTURAL CHEMISTRY. VOL. 14. ISSUE 4. P. 337-348 39 81% 17
9 PALMER, MH , WALKER, IC , (2010) THE ELECTRONIC STATES OF BUTA-1,3-DIENE STUDIED BY AB INITIO CONFIGURATION INTERACTION AND DFT METHODS, AND ELECTRON ENERGY LOSS SPECTROSCOPY.CHEMICAL PHYSICS. VOL. 373. ISSUE 3. P. 159 -169 40 63% 4
10 SCHALK, O , GENG, T , THOMPSON, T , BALUYOT, N , THOMAS, RD , TAPAVICZA, E , HANSSON, T , (2016) CYCLOHEXADIENE REVISITED: A TIME-RESOLVED PHOTOELECTRON SPECTROSCOPY AND AB INITIO STUDY.JOURNAL OF PHYSICAL CHEMISTRY A. VOL. 120. ISSUE 15. P. 2320 -2329 35 56% 1

Classes with closest relation at Level 1


Rank Class id link
1 9648 CONICAL INTERSECTIONS//DIABATIC STATES//NONADIABATIC COUPLING TERMS
2 6341 CEMIN//BENZOBICYCLO321OCTADIENES//BICHROMOPHORIC DYAD
3 28496 1 4 AND 1 6 DIHYDRO 1 2 4 TRIAZINES//1 SILANORBORNENE//2 SILYLNORBORENE
4 8570 PERIDININ//RAMAN SCATTERING CROSS SECTION//PERIDININ CHLOROPHYLL PROTEIN
5 28136 2 PHOTON ABSORPTION SPECTRUM//ANTIAROMATIC MOLECULE//DEPARTIMENTO CHIM SPETTROSCOPIA MOLEC
6 26229 COMPUTER ORIENTED METHODS//VIBRONIC SPECTRA CALCULATION//VI VERNADSKII GEOCHEM ANALYT CHEM
7 7702 BENZENE AOVER TILDE1B2U XOVER TILDE1A1G SYSTEM//MULTI BOND DISSOCIATION//OXALYL BROMIDE
8 25778 1 1 DIBROMO 2 TRIMETHYLSILYLCYCLOPROPANE//1 2 DICYANOCYCLOBUTENE//2 2 DICHLOROCYCLOPROPYLBENZENE
9 23454 MERCURY EXCIPLEX//SCI CHEM 311 TSUSHIMA NAKA//PHOTOSENSITIZED LUMINESCENCE
10 16526 INCREMENT SCHEME//CHEM CONDENSED MATTER SCI//MO COMPUTATIONS

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