Class information for:
Level 2: JOURNAL OF CHEMICAL THEORY AND COMPUTATION//QUANTUM THEORY GRP//OPTIMIZED EFFECTIVE POTENTIAL

Basic class information
ID Publications Average number
of references		 Avg. shr. active
ref. in WoS
377 16473 44.0 66%


Bar chart of Publication_year

Last years might be incomplete

Classes in level above (level 3)


ID, lev.
above		 Publications Label for level above
1 195791 PHYSICS, ATOMIC, MOLECULAR & CHEMICAL//JOURNAL OF MOLECULAR SPECTROSCOPY//JOURNAL OF CHEMICAL PHYSICS

Classes in level below (level 1)


ID, lev. below Publications Label for level below
813 2959 QUANTUM THEORY GRP//OPTIMIZED EFFECTIVE POTENTIAL//HOOKES ATOM
2926 2035 COMPUTAT MOL SCI TECHNOL//BENZENE DIMER//MULLIKEN THEORET CHEM
4064 1778 SELF CONSISTENT FIELD ITERATION//KOHN SHAM EQUATION//LINEAR SCALING
4751 1657 POLARIZABLE CONTINUUM MODEL//NONEQUILIBRIUM SOLVATION//SOLVATION ANALYSIS
6010 1476 ELONGATION METHOD//INCREMENTAL SCHEME//MOLECULAR TAILORING APPROACH
6373 1428 TIME DEPENDENT DENSITY FUNCTIONAL THEORY//GRP CHIM PHYS THEOR STRUCT//CHIM THEOR PL
7404 1292 GW APPROXIMATION//QUASIPARTICLE ENERGY//GW
9387 1092 SPIN POLARIZED ELECTRON GAS//ELECTRON LIQUIDS//ELECTRON GAS
10677 976 QUANTUM MONTE CARLO//CMTH GRP//TRANSCORRELATED METHOD
13800 749 EXTREMELY LOCALIZED MOLECULAR ORBITALS//ASEP MD//LINK ATOM
17715 522 BOYS FUNCTION//ELECTRON REPULSION INTEGRAL//ELECTRON REPULSION INTEGRALS
26152 216 DFTB//DENSITY FUNCTIONAL TIGHT BINDING//GHAEMSHAHR BRANCH
27017 197 SELF CONSISTENT CLUSTER EMBEDDING CALCULATION//FREE CLUSTER CALCULATION//CHIM PHYS 30
33182 96 COLEGIADO ENGN PROD//BOND DEFECTS//MATH PHYS EUROPEAN THEORET SPECT IL ETSF

Terms with highest relevance score


Rank Term Type of term Relevance score
(tfidf)		 Class's shr.
of term's tot.
occurrences		 Shr. of publ.
in class containing
term		 Num. of
publ. in
class
1 JOURNAL OF CHEMICAL THEORY AND COMPUTATION Journal 199 21% 5% 825
2 QUANTUM THEORY GRP Address 110 59% 1% 125
3 OPTIMIZED EFFECTIVE POTENTIAL Author keyword 44 88% 0% 21
4 SELF CONSISTENT CLUSTER EMBEDDING CALCULATION Author keyword 37 100% 0% 14
5 LINEAR SCALING Author keyword 36 50% 0% 51
6 SUPERCOMP Address 30 14% 1% 191
7 COMPUTAT MOL SCI TECHNOL Address 29 37% 0% 62
8 CORRELATION ENERGY Author keyword 28 41% 0% 54
9 THEORETICAL CHEMISTRY ACCOUNTS Journal 27 10% 2% 252
10 TIME DEPENDENT DENSITY FUNCTIONAL THEORY Author keyword 27 22% 1% 107

Web of Science journal categories

Author Key Words


Rank Web of Science journal category Relevance score
(tfidf)		 Class's shr.
of term's tot.
occurrences		 Shr. of publ.
in class containing
term		 Num. of
publ. in
class		 LCSH search Wikipedia search
1 OPTIMIZED EFFECTIVE POTENTIAL 44 88% 0% 21 Search OPTIMIZED+EFFECTIVE+POTENTIAL Search OPTIMIZED+EFFECTIVE+POTENTIAL
2 SELF CONSISTENT CLUSTER EMBEDDING CALCULATION 37 100% 0% 14 Search SELF+CONSISTENT+CLUSTER+EMBEDDING+CALCULATION Search SELF+CONSISTENT+CLUSTER+EMBEDDING+CALCULATION
3 LINEAR SCALING 36 50% 0% 51 Search LINEAR+SCALING Search LINEAR+SCALING
4 CORRELATION ENERGY 28 41% 0% 54 Search CORRELATION+ENERGY Search CORRELATION+ENERGY
5 TIME DEPENDENT DENSITY FUNCTIONAL THEORY 27 22% 1% 107 Search TIME+DEPENDENT+DENSITY+FUNCTIONAL+THEORY Search TIME+DEPENDENT+DENSITY+FUNCTIONAL+THEORY
6 EXACT EXCHANGE 23 74% 0% 17 Search EXACT+EXCHANGE Search EXACT+EXCHANGE
7 POLARIZABLE CONTINUUM MODEL 20 40% 0% 40 Search POLARIZABLE+CONTINUUM+MODEL Search POLARIZABLE+CONTINUUM+MODEL
8 RANGE SEPARATION 20 100% 0% 9 Search RANGE+SEPARATION Search RANGE+SEPARATION
9 KINETIC ENERGY FUNCTIONAL 17 72% 0% 13 Search KINETIC+ENERGY+FUNCTIONAL Search KINETIC+ENERGY+FUNCTIONAL
10 HF CALCULATIONS 17 27% 0% 53 Search HF+CALCULATIONS Search HF+CALCULATIONS

Key Words Plus


Rank Web of Science journal category Relevance score
(tfidf)		 Class's shr.
of term's tot.
occurrences		 Shr. of publ.
in class containing
term		 Num. of
publ. in
class
1 ELECTRONIC STRUCTURE CALCULATIONS 283 34% 4% 670
2 EXCHANGE CORRELATION ENERGY 273 75% 1% 195
3 EXCHANGE CORRELATION POTENTIALS 234 58% 2% 272
4 ELECTRON CORRELATION METHODS 214 73% 1% 165
5 PLESSET PERTURBATION THEORY 202 39% 2% 402
6 KOHN SHAM EQUATIONS 167 84% 1% 92
7 INTEGER DISCONTINUITY 161 89% 0% 73
8 GENERALIZED GRADIENT APPROXIMATION 153 15% 6% 924
9 METALLIC SURFACE 152 73% 1% 116
10 DERIVATIVE DISCONTINUITIES 151 59% 1% 171

Journals


Rank Web of Science journal category Relevance score
(tfidf)		 Class's shr.
of term's tot.
occurrences		 Shr. of publ.
in class containing
term		 Num. of
publ. in
class
1 JOURNAL OF CHEMICAL THEORY AND COMPUTATION 199 21% 5% 825
2 THEORETICAL CHEMISTRY ACCOUNTS 27 10% 2% 252
3 WILEY INTERDISCIPLINARY REVIEWS-COMPUTATIONAL MOLECULAR SCIENCE 6 16% 0% 35

Reviews


Title Publ. year Cit. Active references % act. ref.
to same field
Density functionals with broad applicability in chemistry 2008 2349 54 74%
Universal Solvation Model Based on Solute Electron Density and on a Continuum Model of the Solvent Defined by the Bulk Dielectric Constant and Atomic Surface Tensions 2009 1467 96 78%
ITERATIVE MINIMIZATION TECHNIQUES FOR ABINITIO TOTAL-ENERGY CALCULATIONS - MOLECULAR-DYNAMICS AND CONJUGATE GRADIENTS 1992 5204 59 66%
Challenges for Density Functional Theory 2012 319 260 79%
Density functional theory with London dispersion corrections 2011 400 101 86%
Quantum mechanical continuum solvation models 2005 4598 699 32%
The calculations of excited-state properties with Time-Dependent Density Functional Theory 2013 128 52 88%
Design of density functionals by combining the method of constraint satisfaction with parametrization for thermochemistry, thermochemical kinetics, and noncovalent interactions 2006 1596 115 48%
Electronic excitations: density-functional versus many-body Green's-function approaches 2002 1363 238 66%
Toward reliable density functional methods without adjustable parameters: The PBE0 model 1999 4102 113 29%

Address terms


Rank Address term Relevance score
(tfidf)		 Class's shr.
of term's tot.
occurrences		 Shr. of publ.
in class containing
term		 Num. of
publ. in
class
1 QUANTUM THEORY GRP 110 59% 0.8% 125
2 SUPERCOMP 30 14% 1.2% 191
3 COMPUTAT MOL SCI TECHNOL 29 37% 0.4% 62
4 QUANTUM THEORY PROJECT 23 15% 0.9% 142
5 NANOBIO SPECT GRP 18 27% 0.4% 58
6 MULLIKEN THEORET CHEM 17 27% 0.3% 54
7 QUEENSLAND MICRO NANO TECHNOL 15 88% 0.0% 7
8 GRP CHIM PHYS THEOR STRUCT 14 57% 0.1% 17
9 CHIM THEOR PL 13 22% 0.3% 54
10 LEHRSTUHL THEORET CHEM 13 11% 0.7% 110

Related classes at same level (level 2)


Rank Relatedness score Related classes
1 0.0000022653 CONTRACTED SCHRODINGER EQUATION//SIZE CONSISTENCY//METHOD OF MOMENTS OF COUPLED CLUSTER EQUATIONS
2 0.0000019853 SLATER TYPE ORBITALS//MULTICENTER INTEGRALS//OVERLAP INTEGRALS
3 0.0000014440 VALLEY RIDGE INFLECTION POINT//NEWTON TRAJECTORY//GRADIENT EXTREMAL
4 0.0000014105 QUANTUM SIMILARITY//EENHEID ALGEMENE CHEM//MOL THEORY GRP
5 0.0000013977 HALOGEN BOND//HALOGEN BONDING//SIGMA HOLE
6 0.0000013935 ELECTRON MOMENTUM DENSITY//COMPTON PROFILE//COMPTON SCATTERING
7 0.0000011261 ZEITSCHRIFT FUR PHYSIK D-ATOMS MOLECULES AND CLUSTERS//ATOMIC CLUSTERS//SUPERHALOGEN
8 0.0000010488 COMPUTAT DESIGN DISCOVERY NOVEL MAT//AFLOW//NSF INT MAT
9 0.0000009753 BGAAS//REGIONAL DENSITY FUNCTIONAL THEORY//HIGH P SURE GRP
10 0.0000009675 GEN INORGAN THEORET CHEM//STERLING CHEM//WATER CLUSTERS