Class information for:
Level 1: KS PITZER THEORET CHEM//COMBUST ENERGY FRONTIER//PATH INTEGRAL MOLECULAR DYNAMICS

Basic class information
Class id #P Avg. number of
references		 Database coverage
of references
6965 1423 40.9 65%


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
2689 2             JOURNAL OF CHEMICAL PHYSICS//KENNETH S PITZER THEORET CHEM//KS PITZER THEORET CHEM 3369
6965 1                   KS PITZER THEORET CHEM//COMBUST ENERGY FRONTIER//PATH INTEGRAL MOLECULAR DYNAMICS 1423

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 KS PITZER THEORET CHEM address 162611 1% 63% 12
2 COMBUST ENERGY FRONTIER address 114431 1% 67% 8
3 PATH INTEGRAL MOLECULAR DYNAMICS authKW 80770 1% 47% 8
4 KENNETH S PITZER THEORET CHEM address 76724 2% 15% 24
5 JOURNAL OF CHEMICAL PHYSICS journal 72083 38% 1% 535
6 QUANTUM INSTANTON authKW 64370 0% 100% 3
7 QUANTUM TRANSITION STATE THEORY authKW 64370 0% 100% 3
8 VARIATIONAL PATH INTEGRAL authKW 64370 0% 100% 3
9 CIENCIAS TECN FISICOQUIM address 59388 1% 15% 18
10 RING POLYMER MOLECULAR DYNAMICS authKW 57215 0% 67% 4

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 35514 62% 0% 877
2 Chemistry, Physical 13860 64% 0% 915
3 Physics, Mathematical 1202 9% 0% 124
4 Physics, Multidisciplinary 629 11% 0% 159
5 Physics, Fluids & Plasmas 287 4% 0% 57
6 Physics, Condensed Matter 204 8% 0% 120
7 Computer Science, Interdisciplinary Applications 63 2% 0% 35
8 Mathematics, Interdisciplinary Applications 27 1% 0% 21
9 Optics 13 3% 0% 40
10 Nanoscience & Nanotechnology 0 1% 0% 18

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 KS PITZER THEORET CHEM 162611 1% 63% 12
2 COMBUST ENERGY FRONTIER 114431 1% 67% 8
3 KENNETH S PITZER THEORET CHEM 76724 2% 15% 24
4 CIENCIAS TECN FISICOQUIM 59388 1% 15% 18
5 COMPUTAT SCI MODELING 55168 0% 43% 6
6 PROMOT COMPUTAT SCI E SYST 42914 0% 100% 2
7 COMPUTAT SCI MODELLING 38141 0% 44% 4
8 QUANTUM CHEM PHYS 38141 0% 44% 4
9 HENRY EYRING THEORET CHEM 35283 2% 7% 22
10 CIENCIAS TECN FISIOQUIM 28608 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 CHEMICAL PHYSICS 72083 38% 1% 535
2 CHEMICAL PHYSICS LETTERS 3674 6% 0% 91
3 JOURNAL OF CHEMICAL THEORY AND COMPUTATION 2880 2% 1% 25
4 MOLECULAR PHYSICS 2566 3% 0% 37
5 COMPUTER PHYSICS COMMUNICATIONS 1767 2% 0% 25
6 CHEMICAL PHYSICS 1182 2% 0% 28
7 PHYSICAL REVIEW E 1053 4% 0% 53
8 JOURNAL OF PHYSICAL CHEMISTRY A 1030 3% 0% 39
9 PHYSICS LETTERS A 891 3% 0% 38
10 ADVANCES IN CHEMICAL PHYSICS 719 0% 1% 5

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 PATH INTEGRAL MOLECULAR DYNAMICS 80770 1% 47% 8 Search PATH+INTEGRAL+MOLECULAR+DYNAMICS Search PATH+INTEGRAL+MOLECULAR+DYNAMICS
2 QUANTUM INSTANTON 64370 0% 100% 3 Search QUANTUM+INSTANTON Search QUANTUM+INSTANTON
3 QUANTUM TRANSITION STATE THEORY 64370 0% 100% 3 Search QUANTUM+TRANSITION+STATE+THEORY Search QUANTUM+TRANSITION+STATE+THEORY
4 VARIATIONAL PATH INTEGRAL 64370 0% 100% 3 Search VARIATIONAL+PATH+INTEGRAL Search VARIATIONAL+PATH+INTEGRAL
5 RING POLYMER MOLECULAR DYNAMICS 57215 0% 67% 4 Search RING+POLYMER+MOLECULAR+DYNAMICS Search RING+POLYMER+MOLECULAR+DYNAMICS
6 PATH INTEGRAL MONTE CARLO 53627 1% 25% 10 Search PATH+INTEGRAL+MONTE+CARLO Search PATH+INTEGRAL+MONTE+CARLO
7 PATH INTEGRAL 53409 2% 8% 33 Search PATH+INTEGRAL Search PATH+INTEGRAL
8 BIGELEISEN EQUATION 42914 0% 100% 2 Search BIGELEISEN+EQUATION Search BIGELEISEN+EQUATION
9 CENTROID MOLECULAR DYNAMICS 42914 0% 100% 2 Search CENTROID+MOLECULAR+DYNAMICS Search CENTROID+MOLECULAR+DYNAMICS
10 CENTROID POTENTIAL ENERGY 42914 0% 100% 2 Search CENTROID+POTENTIAL+ENERGY Search CENTROID+POTENTIAL+ENERGY

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 HABERSHON, S , MANOLOPOULOS, DE , MARKLAND, TE , MILLER, TF , (2013) RING-POLYMER MOLECULAR DYNAMICS: QUANTUM EFFECTS IN CHEMICAL DYNAMICS FROM CLASSICAL TRAJECTORIES IN AN EXTENDED PHASE SPACE.ANNUAL REVIEW OF PHYSICAL CHEMISTRY, VOL 64. VOL. 64. ISSUE . P. 387 -413 70 66% 113
2 CERIOTTI, M , FANG, W , KUSALIK, PG , MCKENZIE, RH , MICHAELIDES, A , MORALES, MA , MARKLAND, TE , (2016) NUCLEAR QUANTUM EFFECTS IN WATER AND AQUEOUS SYSTEMS: EXPERIMENT, THEORY, AND CURRENT CHALLENGES.CHEMICAL REVIEWS. VOL. 116. ISSUE 13. P. 7529 -7550 89 36% 17
3 SESE, LM , (2016) PATH INTEGRALS AND EFFECTIVE POTENTIALS IN THE STUDY OF MONATOMIC FLUIDS AT EQUILIBRIUM.ADVANCES IN CHEMICAL PHYSICS, VOL 160. VOL. 160. ISSUE . P. 49 -158 106 55% 0
4 ROSSI, M , CERIOTTI, M , MANOLOPOULOS, DE , (2014) HOW TO REMOVE THE SPURIOUS RESONANCES FROM RING POLYMER MOLECULAR DYNAMICS.JOURNAL OF CHEMICAL PHYSICS. VOL. 140. ISSUE 23. P. - 56 78% 29
5 HELE, TJH , SULEIMANOV, YV , (2015) SHOULD THERMOSTATTED RING POLYMER MOLECULAR DYNAMICS BE USED TO CALCULATE THERMAL REACTION RATES?.JOURNAL OF CHEMICAL PHYSICS. VOL. 143. ISSUE 7. P. - 66 76% 0
6 LIU, J , (2015) RECENT ADVANCES IN THE LINEARIZED SEMICLASSICAL INITIAL VALUE REPRESENTATION/CLASSICAL WIGNER MODEL FOR THE THERMAL CORRELATION FUNCTION.INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY. VOL. 115. ISSUE 11. P. 657 -670 63 67% 7
7 SESE, LM , (2012) ON THE ACCURATE DIRECT COMPUTATION OF THE ISOTHERMAL COMPRESSIBILITY FOR NORMAL QUANTUM SIMPLE FLUIDS: APPLICATION TO QUANTUM HARD SPHERES.JOURNAL OF CHEMICAL PHYSICS. VOL. 136. ISSUE 24. P. - 59 84% 0
8 MIELKE, SL , DINPAJOOH, M , SIEPMANN, JI , TRUHLARA, DG , (2013) EFFICIENT METHODS FOR INCLUDING QUANTUM EFFECTS IN MONTE CARLO CALCULATIONS OF LARGE SYSTEMS: EXTENSION OF THE DISPLACED POINTS PATH INTEGRAL METHOD AND OTHER EFFECTIVE POTENTIAL METHODS TO CALCULATE PROPERTIES AND DISTRIBUTIONS.JOURNAL OF CHEMICAL PHYSICS. VOL. 138. ISSUE 1. P. - 56 84% 5
9 LIU, J , (2014) PATH INTEGRAL LIOUVILLE DYNAMICS FOR THERMAL EQUILIBRIUM SYSTEMS.JOURNAL OF CHEMICAL PHYSICS. VOL. 140. ISSUE 22. P. - 53 78% 3
10 WITT, A , IVANOV, SD , SHIGA, M , FORBERT, H , MARX, D , (2009) ON THE APPLICABILITY OF CENTROID AND RING POLYMER PATH INTEGRAL MOLECULAR DYNAMICS FOR VIBRATIONAL SPECTROSCOPY.JOURNAL OF CHEMICAL PHYSICS. VOL. 130. ISSUE 19. P. - 49 79% 72

Classes with closest relation at Level 1


Rank Class id link
1 4560 SURFACE HOPPING//NONADIABATIC DYNAMICS//JOURNAL OF CHEMICAL PHYSICS
2 37037 LS PHYS//LS//RECIPROCAL OF ACTIVITY
3 19635 OSS2 POTENTIAL//GROTTHUS CHAIN MECHANISM//PROTON DISCHARGE
4 9496 DYNAMIC SOLVENT EFFECT//ACTIVATED RATE PROCESSES//AGMON HOPFIELD MODEL
5 34053 SILICON GR H COMP SYST//INTEGRAL GEOMETRY PROBLEM//TRANSPORT LIKE EQUATION
6 8596 NEUTRON COMPTON SCATTERING//DEEP INELASTIC NEUTRON SCATTERING//NAST NANOSCI NANOTECNOL STRUMENTAZ
7 25500 INFM VITERBO//UNITA INFM ROMA 1//INSTANTANEOUS NORMAL MODES
8 17105 HYDROGEN TUNNELLING//PROMOTING VIBRATION//HYDROGEN TUNNELING
9 23218 SPIN BOSON MODEL//BOSE FERMI KONDO MODEL//COHERENT INCOHERENT TRANSITION
10 18198 DONETSK AA GALKIN PHYS TECHNOL//THREE BODY INTERACTIONS//MANY BODY INTERACTION

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