Class information for: |
Basic class information |
ID | Publications | Average number of references |
Avg. shr. active ref. in WoS |
---|---|---|---|
1 | 195791 | 36.1 | 56% |
Classes in level above (level 4) |
ID, lev. above |
Publications | Label for level above |
---|---|---|
4 | 1732830 | CHEMISTRY, ORGANIC//CHEMISTRY, INORGANIC & NUCLEAR//CHEMISTRY, MULTIDISCIPLINARY |
Classes in level below (level 2) |
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 | PHYSICS, ATOMIC, MOLECULAR & CHEMICAL | WoS category | 22166 | 22% | 46% | 90667 |
2 | JOURNAL OF MOLECULAR SPECTROSCOPY | Journal | 13045 | 87% | 3% | 6480 |
3 | JOURNAL OF CHEMICAL PHYSICS | Journal | 12074 | 35% | 14% | 28207 |
4 | JOURNAL OF PHYSICAL CHEMISTRY A | Journal | 5787 | 40% | 6% | 11242 |
5 | CHEMICAL PHYSICS LETTERS | Journal | 5513 | 32% | 7% | 14315 |
6 | INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY | Journal | 2248 | 40% | 2% | 4356 |
7 | JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM | Journal | 2208 | 39% | 2% | 4405 |
8 | CHEMICAL PHYSICS | Journal | 1933 | 34% | 2% | 4581 |
9 | JOURNAL OF PHYSICAL CHEMISTRY | Journal | 1522 | 23% | 3% | 5701 |
10 | MOLECULAR PHYSICS | Journal | 1339 | 32% | 2% | 3432 |
Web of Science journal categories |
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 | Physics, Atomic, Molecular & Chemical | 22166 | 22% | 46% | 90667 |
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 | DENSITY FUNCTIONAL THEORY | 621 | 19% | 1% | 2917 | Search DENSITY+FUNCTIONAL+THEORY | Search DENSITY+FUNCTIONAL+THEORY |
2 | AB INITIO CALCULATIONS | 530 | 25% | 1% | 1881 | Search AB+INITIO+CALCULATIONS | Search AB+INITIO+CALCULATIONS |
3 | POTENTIAL ENERGY SURFACE | 505 | 59% | 0% | 561 | Search POTENTIAL+ENERGY+SURFACE | Search POTENTIAL+ENERGY+SURFACE |
4 | AB INITIO | 495 | 32% | 1% | 1288 | Search AB+INITIO | Search AB+INITIO |
5 | ROTATIONAL SPECTROSCOPY | 437 | 83% | 0% | 246 | Search ROTATIONAL+SPECTROSCOPY | Search ROTATIONAL+SPECTROSCOPY |
6 | NBO | 401 | 55% | 0% | 499 | Search NBO | Search NBO |
7 | VIBRATIONAL SPECTRA | 375 | 41% | 0% | 719 | Search VIBRATIONAL+SPECTRA | Search VIBRATIONAL+SPECTRA |
8 | POTENTIAL ENERGY SURFACES | 361 | 59% | 0% | 408 | Search POTENTIAL+ENERGY+SURFACES | Search POTENTIAL+ENERGY+SURFACES |
9 | COUPLED CLUSTER CALCULATIONS | 336 | 78% | 0% | 220 | Search COUPLED+CLUSTER+CALCULATIONS | Search COUPLED+CLUSTER+CALCULATIONS |
10 | DFT | 292 | 16% | 1% | 1634 | Search DFT | Search DFT |
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 | AB INITIO | 4717 | 33% | 6% | 11628 |
2 | GAUSSIAN BASIS SETS | 3761 | 51% | 3% | 5299 |
3 | POTENTIAL ENERGY SURFACE | 3596 | 69% | 2% | 3056 |
4 | GAS PHASE | 3435 | 36% | 4% | 7618 |
5 | WAVE FUNCTIONS | 2729 | 49% | 2% | 4012 |
6 | POTENTIAL ENERGY SURFACES | 2708 | 65% | 1% | 2598 |
7 | BASIS SETS | 2527 | 41% | 2% | 4717 |
8 | DENSITY FUNCTIONAL THEORY | 2493 | 26% | 4% | 8418 |
9 | CORRELATED MOLECULAR CALCULATIONS | 2393 | 60% | 1% | 2604 |
10 | MICROWAVE SPECTRUM | 1985 | 72% | 1% | 1568 |
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 MOLECULAR SPECTROSCOPY | 13045 | 87% | 3% | 6480 |
2 | JOURNAL OF CHEMICAL PHYSICS | 12074 | 35% | 14% | 28207 |
3 | JOURNAL OF PHYSICAL CHEMISTRY A | 5787 | 40% | 6% | 11242 |
4 | CHEMICAL PHYSICS LETTERS | 5513 | 32% | 7% | 14315 |
5 | INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY | 2248 | 40% | 2% | 4356 |
6 | JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM | 2208 | 39% | 2% | 4405 |
7 | CHEMICAL PHYSICS | 1933 | 34% | 2% | 4581 |
8 | JOURNAL OF PHYSICAL CHEMISTRY | 1522 | 23% | 3% | 5701 |
9 | MOLECULAR PHYSICS | 1339 | 32% | 2% | 3432 |
10 | JOURNAL OF MOLECULAR STRUCTURE | 1109 | 23% | 2% | 4232 |
Reviews |
Title | Publ. year | Cit. | Active references | % act. ref. to same field |
---|---|---|---|---|
Density functionals with broad applicability in chemistry | 2008 | 2349 | 54 | 91% |
GENERAL ATOMIC AND MOLECULAR ELECTRONIC-STRUCTURE SYSTEM | 1993 | 12362 | 67 | 85% |
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 | 86% |
Toward reliable density functional methods without adjustable parameters: The PBE0 model | 1999 | 4102 | 113 | 79% |
Quantum mechanical continuum solvation models | 2005 | 4598 | 699 | 41% |
Design of density functionals by combining the method of constraint satisfaction with parametrization for thermochemistry, thermochemical kinetics, and noncovalent interactions | 2006 | 1596 | 115 | 82% |
ITERATIVE MINIMIZATION TECHNIQUES FOR ABINITIO TOTAL-ENERGY CALCULATIONS - MOLECULAR-DYNAMICS AND CONJUGATE GRADIENTS | 1992 | 5204 | 59 | 69% |
Challenges for Density Functional Theory | 2012 | 319 | 260 | 91% |
Density functional theory with London dispersion corrections | 2011 | 400 | 101 | 96% |
Molpro: a general-purpose quantum chemistry program package | 2012 | 308 | 88 | 89% |
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 | THEORET CHEM | 1146 | 33% | 1.4% | 2813 |
2 | STATE MOL REACT DYNAM | 481 | 47% | 0.4% | 756 |
3 | COMPUTAT QUANTUM CHEM | 391 | 60% | 0.2% | 427 |
4 | THEORET COMPUTAT CHEM | 327 | 40% | 0.3% | 642 |
5 | COMPUTAT CHEM | 320 | 41% | 0.3% | 598 |
6 | QUIM FIS | 300 | 16% | 0.9% | 1741 |
7 | PHYS THEORET CHEM | 298 | 17% | 0.8% | 1556 |
8 | PHYS ENGG | 288 | 99% | 0.0% | 68 |
9 | CHERRY L EMERSON SCI COMPUTAT | 270 | 53% | 0.2% | 358 |
10 | PHOTOPHYS MOL | 235 | 44% | 0.2% | 402 |
Related classes at same level (level 3) |
Rank | Relatedness score | Related classes |
---|---|---|
1 | 0.0000002363 | JOURNAL OF PHYSICS B-ATOMIC MOLECULAR AND OPTICAL PHYSICS//PHYSICS, ATOMIC, MOLECULAR & CHEMICAL//PHYSICAL REVIEW A |
2 | 0.0000002252 | AROMATICITY//CYCLOPHANES//CYCLACENES |
3 | 0.0000002180 | GRUNWALD WINSTEIN EQUATION//PYRIDINOLYSIS//CROSS INTERACTION CONSTANT |
4 | 0.0000002034 | QUANTUM CASCADE LASERS//QUANTUM CASCADE LASER//QUANTUM CASCADE LASERS QCLS |
5 | 0.0000001488 | PROPELLANTS EXPLOSIVES PYROTECHNICS//ENERGETIC MATERIALS//DETONATION PERFORMANCE |
6 | 0.0000001410 | SURFACE ENHANCED RAMAN SCATTERING//SERS//JOURNAL OF RAMAN SPECTROSCOPY |
7 | 0.0000001312 | POSITRON ANNIHILATION//POSITRONIUM//MAEAM |
8 | 0.0000001256 | FULLERENES//FULLERENE//FULLERENE SCIENCE AND TECHNOLOGY |
9 | 0.0000001229 | JOURNAL OF PHOTOCHEMISTRY AND PHOTOBIOLOGY A-CHEMISTRY//JOURNAL OF PHOTOCHEMISTRY//ESIPT |
10 | 0.0000001220 | JOURNAL OF LOW TEMPERATURE PHYSICS//QUANTUM TURBULENCE//SUPERFLUID HE 3 |