Class information for:
Level 1: REAXFF//CONCURRENT COMP MAT SIMULAT//REAXFF MD

Basic class information
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
6 4 CHEMISTRY, ORGANIC//CHEMISTRY, INORGANIC & NUCLEAR//CHEMISTRY, MULTIDISCIPLINARY 1698077
156 3       PROTEINS-STRUCTURE FUNCTION AND BIOINFORMATICS//PROTEIN FOLDING//PROTEIN STRUCTURE PREDICTION 63028
1871 2             DISSIPATIVE PARTICLE DYNAMICS//MOLECULAR SIMULATION//REAXFF 6394
23656 1                   REAXFF//CONCURRENT COMP MAT SIMULAT//REAXFF MD 361

Terms with highest relevance score


rank Category termType chi_square shrOfCwithTerm shrOfTermInClass termInClass
1 REAXFF authKW 1162421 10% 38% 35
2 CONCURRENT COMP MAT SIMULAT address 851721 6% 49% 20
3 REAXFF MD authKW 392863 2% 75% 6
4 REACTIVE MOLECULAR DYNAMICS authKW 272810 3% 31% 10
5 REACTIVE FORCE FIELD authKW 268240 4% 24% 13
6 ABORAT ADV COMP SIMULAT address 196431 1% 75% 3
7 CHARGE OPTIMIZED MANY BODY COMB POTENTIAL authKW 174607 1% 100% 2
8 CHARGE OPTIMIZED MANY BODY POTENTIAL authKW 174607 1% 100% 2
9 GMD REAX authKW 174607 1% 100% 2
10 HIGH TECHNOL SERV GRP address 174607 1% 100% 2

Web of Science journal categories


chi_square_rank Category chi_square shrOfCwithTerm shrOfTermInClass termInClass
1 Physics, Atomic, Molecular & Chemical 885 20% 0% 73
2 Chemistry, Physical 755 32% 0% 115
3 Computer Science, Interdisciplinary Applications 296 8% 0% 30
4 Materials Science, Multidisciplinary 215 20% 0% 72
5 Energy & Fuels 176 8% 0% 29
6 Nanoscience & Nanotechnology 154 8% 0% 29
7 Physics, Condensed Matter 116 11% 0% 41
8 Engineering, Chemical 100 8% 0% 30
9 Physics, Mathematical 65 4% 0% 16
10 Materials Science, Ceramics 42 2% 0% 9

Address terms


chi_square_rank term chi_square shrOfCwithTerm shrOfTermInClass termInClass
1 CONCURRENT COMP MAT SIMULAT 851721 6% 49% 20
2 ABORAT ADV COMP SIMULAT 196431 1% 75% 3
3 HIGH TECHNOL SERV GRP 174607 1% 100% 2
4 COMP SCI ABORATORY ADV COMP SIMULAT 116403 1% 67% 2
5 MAT PROC SIMULAT 92995 7% 4% 27
6 ABORAT ADV COMP SIMULAT CHEM ENGN MA 87303 0% 100% 1
7 BECKMAN 139 174 87303 0% 100% 1
8 CCLMS 87303 0% 100% 1
9 CHEM ENGN MAT SCI ABORATORY ADV COMP 87303 0% 100% 1
10 CHEM ENGN MAT SCI ABORATORY COMP SIM 87303 0% 100% 1

Journals


chi_square_rank term chi_square shrOfCwithTerm shrOfTermInClass termInClass
1 IEEE COMPUTATIONAL SCIENCE & ENGINEERING 3059 1% 2% 2
2 JOURNAL OF PHYSICAL CHEMISTRY A 2389 8% 0% 29
3 COMPUTER PHYSICS COMMUNICATIONS 2250 4% 0% 14
4 COMPUTATIONAL MATERIALS SCIENCE 1696 3% 0% 12
5 JOURNAL OF CHEMICAL THEORY AND COMPUTATION 1428 2% 0% 9
6 JOURNAL OF COMPUTATIONAL CHEMISTRY 1374 3% 0% 10
7 REVIEWS IN COMPUTATIONAL CHEMISTRY 1132 0% 1% 1
8 ENERGY & FUELS 973 3% 0% 12
9 COMPUTING IN SCIENCE & ENGINEERING 888 1% 0% 3
10 JOURNAL OF MOLECULAR MODELING 809 2% 0% 6

Author Key Words


chi_square_rank term chi_square shrOfCwithTerm shrOfTermInClass termInClass LCSH search Wikipedia search
1 REAXFF 1162421 10% 38% 35 Search REAXFF Search REAXFF
2 REAXFF MD 392863 2% 75% 6 Search REAXFF+MD Search REAXFF+MD
3 REACTIVE MOLECULAR DYNAMICS 272810 3% 31% 10 Search REACTIVE+MOLECULAR+DYNAMICS Search REACTIVE+MOLECULAR+DYNAMICS
4 REACTIVE FORCE FIELD 268240 4% 24% 13 Search REACTIVE+FORCE+FIELD Search REACTIVE+FORCE+FIELD
5 CHARGE OPTIMIZED MANY BODY COMB POTENTIAL 174607 1% 100% 2 Search CHARGE+OPTIMIZED+MANY+BODY+COMB+POTENTIAL Search CHARGE+OPTIMIZED+MANY+BODY+COMB+POTENTIAL
6 CHARGE OPTIMIZED MANY BODY POTENTIAL 174607 1% 100% 2 Search CHARGE+OPTIMIZED+MANY+BODY+POTENTIAL Search CHARGE+OPTIMIZED+MANY+BODY+POTENTIAL
7 GMD REAX 174607 1% 100% 2 Search GMD+REAX Search GMD+REAX
8 VARMD 174607 1% 100% 2 Search VARMD Search VARMD
9 REACTIVE FORCE FIELDS 126982 1% 36% 4 Search REACTIVE+FORCE+FIELDS Search REACTIVE+FORCE+FIELDS
10 REACTIVE DYNAMICS SIMULATIONS 116403 1% 67% 2 Search REACTIVE+DYNAMICS+SIMULATIONS Search REACTIVE+DYNAMICS+SIMULATIONS

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.

Classes with closest relation at Level 1


rank cluster_id2 link
1 25357 CROSS LINKED EPOXY//CROSS LINKED EPOXY RESIN//CROSS LINK INHOMOGENEITY
2 36997 HIGH PERFORMANCE SIMULATION//AMORPHOUS TITANIA GROWTH//ASSISTED ION DEPOSITION
3 6273 POLARIZABLE FORCE FIELD//HYBRIDIZATION DISPLACEMENT CHARGE//ELECTRONEGATIVITY EQUALIZATION METHOD
4 1577 CL 20//PROPELLANTS EXPLOSIVES PYROTECHNICS//HMX
5 10549 MAEAM//MODIFIED EMBEDDED ATOM METHOD//EMBEDDED ATOM METHOD
6 25340 GAMMA SI3N4//TIN NITRIDE//CUBIC SILICON NITRIDE
7 9732 X RAY ABSORPTION METHOD//AMORPHOUS SILICA NANOWIRES//BASAL MAGMA OCEAN
8 10918 QUASICONTINUUM METHOD//QUASICONTINUUM//ATOMISTIC TO CONTINUUM
9 37076 1 AMINO 2 ACETYL ANTHRAQUINONE//HOMOHELICAL INTERACTION//LINDEMANN MECHANISM
10 31513 ANHYDROUS MAGNESIUM CHLORIDE//MAGNESIUM CHLORIDE HEXAMMONIATE//BISCHOFITE

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