Class information for:
Level 1: ELECTRON LOCALIZATION FUNCTION//23 CYCLOADDITION//CHIM THEOR

Basic class information
Class id #P Avg. number of
references		 Database coverage
of references
14140 789 44.1 62%


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
384 2             PHYSICS, ATOMIC, MOLECULAR & CHEMICAL//JOURNAL OF COMPUTATIONAL CHEMISTRY//CHEMISTRY, PHYSICAL 17031
14140 1                   ELECTRON LOCALIZATION FUNCTION//23 CYCLOADDITION//CHIM THEOR 789

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 ELECTRON LOCALIZATION FUNCTION authKW 892077 7% 39% 59
2 23 CYCLOADDITION authKW 323029 3% 35% 24
3 CHIM THEOR address 293753 13% 7% 104
4 UMR 7616 address 286970 7% 13% 57
5 ELF TOPOLOGICAL ANALYSIS authKW 193500 1% 100% 5
6 ATOMIC SHELL STRUCTURE authKW 176907 1% 57% 8
7 ELECTRON LOCALIZABILITY authKW 174147 1% 75% 6
8 DELOCALIZATION INDEX authKW 174141 1% 50% 9
9 FERMI HOLE authKW 174141 1% 50% 9
10 ELECTRON LOCALIZATION FUNCTION ELF authKW 167226 1% 39% 11

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 6584 36% 0% 286
2 Chemistry, Physical 4949 52% 0% 413
3 Chemistry, Multidisciplinary 1308 28% 0% 220
4 Chemistry, Organic 528 13% 0% 103
5 Mathematics, Interdisciplinary Applications 244 4% 0% 35
6 Chemistry, Inorganic & Nuclear 177 6% 0% 50
7 Computer Science, Interdisciplinary Applications 20 2% 0% 16
8 Crystallography 10 2% 0% 13
9 Education, Scientific Disciplines 6 1% 0% 5
10 History & Philosophy of Science 1 0% 0% 2

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 CHIM THEOR 293753 13% 7% 104
2 UMR 7616 286970 7% 13% 57
3 UMR CNRS 7616 148834 1% 38% 10
4 QUIM FIS ANALIT 106118 8% 4% 65
5 QUIM TEOR 103355 3% 12% 23
6 SYNTHESE BIOCATALYSE ORGAN 77400 0% 100% 2
7 SYNTH BIOCATALYSIS ORGAN 69657 0% 60% 3
8 PM GROSS CHEM 58372 2% 12% 13
9 ORGAN CHEM TECHNOL 53926 7% 2% 56
10 DIFFRACTOMETR 10 51599 0% 67% 2

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 COMPUTATIONAL CHEMISTRY 19791 7% 1% 56
2 THEORETICAL CHEMISTRY ACCOUNTS 17095 4% 1% 35
3 JOURNAL OF PHYSICAL CHEMISTRY A 9762 11% 0% 87
4 JOURNAL OF CHEMICAL THEORY AND COMPUTATION 5663 3% 1% 26
5 COMPUTATIONAL AND THEORETICAL CHEMISTRY 5407 2% 1% 18
6 INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY 3523 4% 0% 32
7 FOUNDATIONS OF CHEMISTRY 1884 0% 2% 2
8 CHEMICAL PHYSICS LETTERS 1076 5% 0% 37
9 MOLECULAR PHYSICS 971 2% 0% 17
10 PHYSICAL CHEMISTRY CHEMICAL PHYSICS 724 3% 0% 23

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 ELECTRON LOCALIZATION FUNCTION 892077 7% 39% 59 Search ELECTRON+LOCALIZATION+FUNCTION Search ELECTRON+LOCALIZATION+FUNCTION
2 23 CYCLOADDITION 323029 3% 35% 24 Search 23+CYCLOADDITION Search 23+CYCLOADDITION
3 ELF TOPOLOGICAL ANALYSIS 193500 1% 100% 5 Search ELF+TOPOLOGICAL+ANALYSIS Search ELF+TOPOLOGICAL+ANALYSIS
4 ATOMIC SHELL STRUCTURE 176907 1% 57% 8 Search ATOMIC+SHELL+STRUCTURE Search ATOMIC+SHELL+STRUCTURE
5 ELECTRON LOCALIZABILITY 174147 1% 75% 6 Search ELECTRON+LOCALIZABILITY Search ELECTRON+LOCALIZABILITY
6 DELOCALIZATION INDEX 174141 1% 50% 9 Search DELOCALIZATION+INDEX Search DELOCALIZATION+INDEX
7 FERMI HOLE 174141 1% 50% 9 Search FERMI+HOLE Search FERMI+HOLE
8 ELECTRON LOCALIZATION FUNCTION ELF 167226 1% 39% 11 Search ELECTRON+LOCALIZATION+FUNCTION+ELF Search ELECTRON+LOCALIZATION+FUNCTION+ELF
9 MOLECULAR ELECTRON DENSITY THEORY 161248 1% 83% 5 Search MOLECULAR+ELECTRON+DENSITY+THEORY Search MOLECULAR+ELECTRON+DENSITY+THEORY
10 PARR FUNCTIONS 161248 1% 83% 5 Search PARR+FUNCTIONS Search PARR+FUNCTIONS

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 ANDRES, J , BERSKI, S , SILVI, B , (2016) CURLY ARROWS MEET ELECTRON DENSITY TRANSFERS IN CHEMICAL REACTION MECHANISMS: FROM ELECTRON LOCALIZATION FUNCTION (ELF) ANALYSIS TO VALENCE-SHELL ELECTRON-PAIR REPULSION (VSEPR) INSPIRED INTERPRETATION.CHEMICAL COMMUNICATIONS. VOL. 52. ISSUE 53. P. 8183 -8195 70 61% 0
2 DOMINGO, LR , (2014) A NEW C-C BOND FORMATION MODEL BASED ON THE QUANTUM CHEMICAL TOPOLOGY OF ELECTRON DENSITY.RSC ADVANCES. VOL. 4. ISSUE 61. P. 32415 -32428 47 61% 48
3 CAUSA, M , SAVIN, A , SILVI, B , (2014) ATOMS AND BONDS IN MOLECULES AND CHEMICAL EXPLANATIONS.FOUNDATIONS OF CHEMISTRY. VOL. 16. ISSUE 1. P. 3 -26 51 64% 4
4 DOMINGO, LR , (2016) MOLECULAR ELECTRON DENSITY THEORY: A MODERN VIEW OF REACTIVITY IN ORGANIC CHEMISTRY.MOLECULES. VOL. 21. ISSUE 10. P. - 38 68% 2
5 FRANCISCO, E , PENDAS, AM , BLANCO, MA , (2009) A CONNECTION BETWEEN DOMAIN-AVERAGED FERMI HOLE ORBITALS AND ELECTRON NUMBER DISTRIBUTION FUNCTIONS IN REAL SPACE.JOURNAL OF CHEMICAL PHYSICS. VOL. 131. ISSUE 12. P. - 35 83% 7
6 SILVI, B , REINHARDT, P , (2011) LOCALIZATION AND LOCALIZABILITY IN QUANTUM ORGANIC CHEMISTRY: LOCALIZED ORBITALS AND LOCALIZATION FUNCTIONS.CURRENT ORGANIC CHEMISTRY. VOL. 15. ISSUE 20. P. 3555 -3565 57 44% 2
7 DOMINGO, LR , RIOS-GUTIERREZ, M , PEREZ, P , (2016) A NEW MODEL FOR C-C BOND FORMATION PROCESSES DERIVED FROM THE MOLECULAR ELECTRON DENSITY THEORY IN THE STUDY OF THE MECHANISM OF [3+2] CYCLOADDITION REACTIONS OF CARBENOID NITRILE YLIDES WITH ELECTRON-DEFICIENT ETHYLENES.TETRAHEDRON. VOL. 72. ISSUE 12. P. 1524 -1532 31 62% 2
8 DOMINGO, LR , RIOS-GUTIERREZ, M , CHAMORRO, E , PEREZ, P , (2016) ELECTROPHILIC ACTIVATION OF CO2 IN CYCLOADDITION REACTIONS TOWARDS A NUCLEOPHILIC CARBENOID INTERMEDIATE: NEW DEFYING INSIGHTS FROM THE MOLECULAR ELECTRON DENSITY THEORY.THEORETICAL CHEMISTRY ACCOUNTS. VOL. 136. ISSUE 1. P. - 49 44% 0
9 POATER, J , DURAN, M , SOLA, M , SILVI, B , (2005) THEORETICAL EVALUATION OF ELECTRON DELOCALIZATION IN AROMATIC MOLECULES BY MEANS OF ATOMS IN MOLECULES (AIM) AND ELECTRON LOCALIZATION FUNCTION (ELF) TOPOLOGICAL APPROACHES.CHEMICAL REVIEWS. VOL. 105. ISSUE 10. P. 3911 -3947 74 26% 349
10 CONTRERAS-GARCIA, J , RECIO, JM , (2011) ELECTRON DELOCALIZATION AND BOND FORMATION UNDER THE ELF FRAMEWORK.THEORETICAL CHEMISTRY ACCOUNTS. VOL. 128. ISSUE 4-6. P. 411-418 27 84% 10

Classes with closest relation at Level 1


Rank Class id link
1 15746 MOLECULAR INFORMATION CHANNELS//MOLECULAR COMMUNICATION SYSTEMS//ORBITAL COMMUNICATION THEORY
2 3594 MOL THEORY GRP//ATOMS IN MOLECULES//INTERATOMIC SURFACE
3 14962 VALENCE BOND//VALENCE BOND THEORY//CASVB
4 3482 FUKUI FUNCTION//CONCEPTUAL DFT//EENHEID ALGEMENE CHEM
5 15296 ASYNCHRONOUS CONCERTED REACTION//BISTRIFLUOROMETHANESULFONYLMETHANE//CILC IRC
6 5181 COMPUTAT CHEM//COMPUTAT QUANTUM CHEM//METAL METAL BONDING
7 11873 ELECTRON PAIR DENSITY//PL CHEM UNIT//EXTRACULE DENSITY
8 30641 SHANDITE//HALF ANTIPEROVSKITES//HETEROMETALLIC BONDS
9 3429 AROMATICITY//NICS//RING CURRENTS
10 21797 AGOSTIC INTERACTIONS//HEXAMETHYL COMPLEXES//MATRIX INFRARED SPECTRA

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