KOCH, Henrik
 Distribuzione geografica
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Continente #
NA - Nord America 4.687
EU - Europa 4.487
AS - Asia 1.948
SA - Sud America 113
Continente sconosciuto - Info sul continente non disponibili 35
AF - Africa 10
OC - Oceania 1
Totale 11.281
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Nazione #
US - Stati Uniti d'America 4.654
IE - Irlanda 1.430
IT - Italia 1.129
CN - Cina 716
TR - Turchia 583
RU - Federazione Russa 562
SG - Singapore 540
SE - Svezia 538
UA - Ucraina 435
DE - Germania 254
BR - Brasile 96
EU - Europa 35
HK - Hong Kong 30
CA - Canada 26
NO - Norvegia 25
FI - Finlandia 24
ID - Indonesia 23
CH - Svizzera 18
BE - Belgio 16
JP - Giappone 13
GB - Regno Unito 11
NL - Olanda 10
PL - Polonia 9
AT - Austria 8
IR - Iran 8
DK - Danimarca 7
VN - Vietnam 7
FR - Francia 6
IN - India 6
MX - Messico 6
IL - Israele 4
IQ - Iraq 4
AR - Argentina 3
BO - Bolivia 3
CL - Cile 3
CO - Colombia 3
MA - Marocco 3
TN - Tunisia 3
TW - Taiwan 3
BD - Bangladesh 2
CZ - Repubblica Ceca 2
EC - Ecuador 2
EG - Egitto 2
OM - Oman 2
PE - Perù 2
PK - Pakistan 2
SN - Senegal 2
AU - Australia 1
BA - Bosnia-Erzegovina 1
BH - Bahrain 1
DO - Repubblica Dominicana 1
ES - Italia 1
JO - Giordania 1
KH - Cambogia 1
LA - Repubblica Popolare Democratica del Laos 1
PY - Paraguay 1
RO - Romania 1
SA - Arabia Saudita 1
Totale 11.281
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Città #
Dublin 1.428
Jacksonville 993
Pisa 836
Boardman 517
Chandler 496
Izmir 457
Lawrence 269
Singapore 255
Ashburn 243
Boston 213
Millbury 213
Wilmington 205
Moscow 156
New York 156
Dearborn 149
San Mateo 148
Istanbul 123
Beijing 110
Ogden 95
Bremen 88
Hefei 76
Scuola 58
Guangzhou 56
Ann Arbor 51
Shanghai 47
Nanjing 41
Kunming 39
Santa Clara 36
Andover 35
Wuhan 30
Hong Kong 27
Milan 24
Toronto 24
Washington 24
Fairfield 23
Helsinki 23
Jakarta 23
Jinan 23
Seattle 22
The Dalles 21
Nanchang 20
Las Vegas 19
Brussels 16
Trondheim 16
Voghera 16
Bern 15
Norwalk 14
Houston 12
Jiaxing 11
Shenyang 11
Chicago 10
Florence 10
Rome 10
Tokyo 10
Jinhua 9
Warsaw 9
Chongqing 8
Ningbo 8
Dong Ket 7
Hebei 7
San Giuliano Terme 7
Vienna 7
Woodbridge 7
Cusano Milanino 6
Frankfurt am Main 6
Nanning 6
Nuremberg 6
Shenzhen 6
São Paulo 6
Yiwu 6
Centro 5
Chengdu 5
Fuzhou 5
Laurel 5
North Bergen 5
Amsterdam 4
Belo Horizonte 4
Cambridge 4
Catania 4
Council Bluffs 4
Los Angeles 4
Shaoxing 4
Wenzhou 4
Wuxi 4
Zanjan 4
Baotou 3
Bologna 3
Brescia 3
Changsha 3
Contagem 3
Düsseldorf 3
Grosseto 3
Mexico City 3
Oslo 3
Padova 3
San Diego 3
San Francisco 3
San Paolo di Civitate 3
Serra 3
Signa 3
Totale 8.264
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Nome #
A theoretical and experimental benchmark study of core-excited states in nitrogen 149
The effect of intermolecular interactions on the electric properties of helium and argon. II. The dielectric, refractivity, Kerr, and hyperpolarizability second virial coefficients 129
E T1.0: An open source electronic structure program with emphasis on coupled cluster and multilevel methods 123
Multilevel Density Functional Theory 118
The Dalton quantum chemistry program system 108
Density-Based Multilevel Hartree-Fock Model 107
Communication: X-ray absorption spectra and core-ionization potentials within a core-valence separated coupled cluster framework 107
Combining multilevel Hartree-Fock and multilevel coupled cluster approaches with molecular mechanics: a study of electronic excitations in solutions 106
The Cotton - Mouton effect of liquid water. Part II: The semi-continuum model 105
Ab initio potential-energy surface and rovibrational states of the HCN-HCl complex 104
Ab initio calculation of the frequency-dependent interaction induced hyperpolarizability of Ar-2 101
Excitation energies from the coupled cluster singles and doubles linear response function (CCSDLR). Applications to Be, CH+, CO, and H2O 100
Accurate ab initio density fitting for multiconfigurational self-consistent field methods 100
The effect of intermolecular interactions on the electric properties of helium and argon. I. Ab initio calculation of the interaction induced polarizability and hyperpolarizability in He-2 and Ar-2 99
Basis-set convergence of correlated calculations on water 99
Tautomerization of Thymine Using Ultraviolet Light 98
Integral-direct coupled cluster calculations of frequency-dependent polarizabilities, transition probabilities and excited-state properties 98
Benzene-argon S-1 intermolecular potential energy surface 98
Coupled cluster energy derivatives. Analytic Hessian for the closed-shell coupled cluster singles and doubles wave function: Theory and applications 96
Probing ultrafast ππ*/nπ* internal conversion in organic chromophores via K-edge resonant absorption 96
Accurate Description of Photoionization Dynamical Parameters 96
The effect of intermolecular interactions on the electric properties of helium and argon. III - Quantum statistical calculations of the dielectric second virial coefficients 95
Research note: Scf calculations of the nmr shielding tensor for the ethylenic carbon atom in C3Cl4 94
Near-Edge X-ray Absorption Fine Structure within Multilevel Coupled Cluster Theory 94
An analysis of the performance of coupled cluster methods for K-edge core excitations and ionizations using standard basis sets 93
Benzene-argon triplet intermolecular potential energy surface 92
A direct atomic orbital driven implementation of the coupled cluster singles and doubles (CCSD) model 91
Coupled cluster response calculation of natural chiroptical spectra 90
Erratum: Communication: X-ray absorption spectra and core-ionization potentials within a core-valence separated coupled cluster framework (Journal Of Chemical Physics (2015) 143 (181103)) 90
Crossing conditions in coupled cluster theory 89
Accurate ab initio rovibronic spectrum of the X 1 Sigma(+)(g) and B 1 Sigma(+)(u) in Ar-2 89
Coupled cluster response functions 88
Basis set limits of the second order Møller-Plesset correlation energies of water, methane, acetylene, ethylene, and benzene 88
The second-order approximate coupled cluster singles and doubles model CC2 88
Correlated natural transition orbitals for core excitation energies in multilevel coupled cluster models 88
Static polarizabilities and dipole moment derivatives for the closed shell coupled cluster singles and doubles wave function 87
C24: Ring or fullerene? 87
Multilevel CC2 and CCSD Methods with Correlated Natural Transition Orbitals 87
Time-dependent coupled-cluster theory for ultrafast transient-absorption spectroscopy 87
A ReaxFF force field for sodium intrusion in graphitic cathodes 86
Accurate intermolecular ground state potential of the Ar-N-2 complex 85
The benzene-argon complex: A ground and excited state ab initio study 85
A variational matrix decomposition applied to full configuration-interaction calculations 84
Ab initio calculation of optical rotation in (P)-(+)-[4]triangulane 84
The multilevel CC3 coupled cluster model 84
Assessment of density functionals for van der Waals complexes of sodium and benzene 84
Multi-level coupled cluster theory 83
Atomic integral driven second order polarization propagator calculations of the excitation spectra of naphthalene and anthracene 83
The extended CC2 model ECC2 83
A coupled cluster calculation of the spectrum of urea 83
Analytical calculation of full configuration interaction response properties: Application to be 83
A second-order doubles correction to excitation energies in the random-phase approximation 83
An efficient algorithm for Cholesky decomposition of electron repulsion integrals 83
Basis-set convergence in correlated calculations on Ne, N2, and H2O 82
Large-scale calculations of excitation energies in coupled cluster theory: The singlet excited states of benzene 82
Brueckner coupled cluster response functions 82
Density Functional Theory Study on the Interactions of Metal Ions with Long Chain Deprotonated Carboxylic Acids 82
The vibrational and temperature dependence of the indirect nuclear spin-spin coupling constants of the oxonium (H3O+) and hydroxyl (OH-) ions 82
Spin adapted implementation of EOM-CCSD for triplet excited states: Probing intersystem crossings of acetylacetone at the carbon and oxygen K-edges 82
Coupled cluster response theory in parameter subspaces 81
Efficient parallel implementation of response theory: Calculations of the second hyperpolarizability of polyacenes 81
Gauge invariant coupled cluster response theory 81
The Hartree–Fock magnetizability of C60 81
Gauge invariant coupled cluster response theory using optimized nonorthogonal orbitals 80
Observation of ultrafast intersystem crossing in thymine by extreme ultraviolet time-resolved photoelectron spectroscopy 80
Optical Rotation from Coupled Cluster and Density Functional Theory: The Role of Basis Set Convergence 79
Surprising cases of divergent behavior in Møller-Plesset perturbation theory 79
Carbon nanorings: A challenge to theoretical chemistry 79
The helium-, neon-, and argon-cyclopropane van der waals complexes: Ab initio ground state intermolecular potential energy surfaces and intermolecular dynamics 79
Computational and experimental investigation of intermolecular states and forces in the benzene-helium van der Waals complex 79
A systematic ab initio study of the water dimer in hierarchies of basis sets and correlation models 79
FREQUENCY-DEPENDENT HYPERPOLARIZABILITIES OF POLYYNES 79
Calculation of frequency-dependent polarizabilities using coupled-cluster response theory 78
Large scale random phase calculations for direct self-consistent field wavefunctions 78
DIRECT ATOMIC ORBITAL BASED SELF-CONSISTENT-FIELD CALCULATIONS OF NONLINEAR MOLECULAR-PROPERTIES - APPLICATION TO THE FREQUENCY-DEPENDENT HYPERPOLARIZABILITY OF PARA-NITROANILINE 78
Dynamic CCSD polarisabilities of CHF3 and CHCl3 77
On the time-dependent Lagrangian approach in quantum chemistry 77
Resolving the notorious case of conical intersections for coupled cluster dynamics 77
Implementation of electronic ground states and singlet and triplet excitation energies in coupled cluster theory with approximate triples corrections 77
An Orbital Invariant Similarity Constrained Coupled Cluster Model 77
Study of the benzene·N2intermolecular potential-energy surface 76
Random-phase calculations of frequency-dependent polarizabilities and hyperpolarizabilities of long polyene chains 76
Comment on "Frequency-dependent equation-of-motion coupled cluster hyperpolarizabilities: Resolution of the discrepancy between theory and experiment for HF?" [J Chem Phys 107,10823(1997)] 76
Variation of polarizability in the [4n + 2] annulene series: from [22]- to [66]-annulene 75
Polarizability and optical rotation calculated from the approximate coupled cluster singles and doubles CC2 linear response theory using cholesky decompositions 75
Branching ratios for the dissociative decay of triplet H2 75
Energy-Based Molecular Orbital Localization in a Specific Spatial Region 75
Biorthonormal Formalism for Nonadiabatic Coupled Cluster Dynamics 75
Comment on "The importance of high-order correlation effects for the CO-CO interaction potential" - [Chem. Phys. Lett. 314 (1999) 326] 74
Response functions in the CC3 iterative triple excitation model 74
Coupled cluster response functions revisited 74
Quartic coupled cluster force fields for the diazene isomers 74
Potential Energy Surfaces and Charge Transfer of PAH-Sodium-PAH Complexes 73
Polarizabilities of small annulenes from Cholesky CC2 linear response theory 73
The integral-direct coupled cluster singles and doubles model 73
Theoretical electronic absorption and natural circular dichroism spectra of (-)-trans-cyclooctene 73
The CCSD(T) model with Cholesky decomposition of orbital energy denominators 73
Argon broadening of the13CO R(0) and R(7) transitions in the fundamental band at temperatures between 80 and 297 K: Comparison between experiment and theory 72
Theoretical absorption spectrum of the Ar-CO van der Waals complex 72
Integral direct calculation of CC2 excitation energies: singlet excited states of benzene 71
Totale 8.654
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Categoria #
all - tutte 65.098
article - articoli 0
book - libri 0
conference - conferenze 0
curatela - curatele 0
other - altro 0
patent - brevetti 0
selected - selezionate 0
volume - volumi 0
Totale 65.098
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Totale Lug Ago Sett Ott Nov Dic Gen Feb Mar Apr Mag Giu
2019/2020166 0 0 0 0 0 0 0 0 0 35 129 2
2020/20211.181 134 3 130 5 130 9 147 163 3 268 3 186
2021/2022961 9 4 8 77 80 4 16 107 57 81 9 509
2022/20233.612 452 213 123 150 97 313 1 928 1.233 16 22 64
2023/20241.430 80 31 125 32 38 784 20 19 147 27 10 117
2024/20252.278 185 56 147 202 583 50 27 108 832 88 0 0
Totale 11.536