Roberto Orlando - Publications, H-index & Citations

Roberto Orlando

University of Turin

54H指数

233论文数

1.4W被引数

收录论文 54

发表时间

The three channels of many-body perturbation theory: GW, particle-particle, and electron-hole T-matrix self-energies

JOURNAL OF CHEMICAL PHYSICS

IF3.1

2023-11-14

OAAI

Orlando, Roberto; Romaniello, Pina; Loos, Pierre-Francois

Quantum-mechanical condensed matter simulations with CRYSTAL

WILEY INTERDISCIPLINARY REVIEWS-COMPUTATIONAL MOLECULAR SCIENCE

IF27

2018-03-04

1.5K

OAAI

Dovesi, Roberto; Erba, Alessandro; Orlando, Roberto; Zicovich-Wilson, Claudio M.; Civalleri, Bartolomeo; Maschio, Lorenzo; Rerat, Michel; Casassa, Silvia; Baima, Jacopo; Salustro, Simone; Kirtman, Bernard

Assessment of Different Quantum Mechanical Methods for the Prediction of Structure and Cohesive Energy of Molecular Crystals

JOURNAL OF CHEMICAL THEORY AND COMPUTATION

IF5.5

2016-06-29

PREAI

Cutini, Michele; Civalleri, Bartolomeo; Corno, Marta; Orlando, Roberto; Brandenburg, Jan Gerit; Maschio, Lorenzo; Ugliengo, Piero

Measuring the Elasticity of Poly-L-Proline Helices with Terahertz Spectroscopy 用太赫兹光谱测量聚L-脯氨酸螺旋的弹性

ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

IF16.9

2016-04-28

OAAI

Ruggiero, Michael T.; Sibik, Juraj; Orlando, Roberto; Zeitler, J. Axel; Korter, Timothy M.

Elucidating the fundamental forces in protein crystal formation: the case of crambin

CHEMICAL SCIENCE

IF7.4

2016-01-01

OAAI

Delle Piane, Massimo; Corno, Marta; Orlando, Roberto; Dovesi, Roberto; Ugliengo, Piero

Electron density analysis of large (molecular and periodic) systems: A parallel implementation

JOURNAL OF COMPUTATIONAL CHEMISTRY

IF4.8

2015-07-31

OAAI

Casassa, Silvia; Erba, Alessandro; Baima, Jacopo; Orlando, Roberto

Ab Initio Calculation of the Ultraviolet-Visible (UV-vis) Absorption Spectrum, Electron-Loss Function, and Reflectivity of Solids

JOURNAL OF CHEMICAL THEORY AND COMPUTATION

IF5.5

2015-06-03

OAAI

Ferrari, Anna Maria; Orlando, Roberto; Rerat, Michel

Probing the Multiple Structures of Vaterite through Combined Computational and Experimental Raman Spectroscopy

JOURNAL OF PHYSICAL CHEMISTRY C

IF3.2

2014-11-17

OAAI

De La Pierre, Marco; Demichelis, Raffaella; Wehrmeister, Ursula; Jacob, Dorrit E.; Raiteri, Paolo; Gale, Julian D.; Orlando, Roberto

On the full exploitation of symmetry in periodic (as well as molecular) self-consistent-field ab initio calculations

JOURNAL OF CHEMICAL PHYSICS

IF3.1

2014-09-11

OAAI

Orlando, Roberto; De La Pierre, Marco; Zicovich-Wilson, Claudio M.; Erba, Alessandro; Dovesi, Roberto

Exploitation of symmetry in periodic Self-Consistent-Field ab initio calculations: application to large three-dimensional compounds

SCIENCE CHINA-CHEMISTRY

IF9.7

2014-08-20

OAAI

De La Pierre, Marco; Orlando, Roberto; Ferrabone, Matteo; Zicovich-Wilson, Claudio M.; Dovesi, Roberto

The Raman spectrum of CaCO3 polymorphs calcite and aragonite: A combined experimental and computational study

JOURNAL OF CHEMICAL PHYSICS

IF3.1

2014-04-25

152

OAAI

De La Pierre, Marco; Carteret, Cedric; Maschio, Lorenzo; Andre, Erwan; Orlando, Roberto; Dovesi, Roberto

Low-temperature phase of BaTiO3: Piezoelectric, dielectric, elastic, and photoelastic properties from ab initio simulations

PHYSICAL REVIEW B

IF3.7

2014-01-06

OAAI

Mahmoud, A.; Erba, A.; El-Kelany, Kh. E.; Rerat, M.; Orlando, R.

Ab initio analytical Raman intensities for periodic systems through a coupled perturbed Hartree-Fock/Kohn-Sham method in an atomic orbital basis. II. Validation and comparison with experiments 在原子轨道基础上，通过耦合扰动的hartree-fock/kohn-sham方法对周期系统进行从头算分析拉曼强度。二。通过实验进行验证和比较

JOURNAL OF CHEMICAL PHYSICS

IF3.1

2013-10-22

170

OAAI

Maschio, Lorenzo; Kirtman, Bernard; Rerat, Michel; Orlando, Roberto; Dovesi, Roberto

Beryllium Oxide Nanotubes and their Connection to the Flat Monolayer

JOURNAL OF PHYSICAL CHEMISTRY C

IF3.2

2013-06-11

OAAI

Baima, J.; Erba, A.; Rerat, M.; Orlando, R.; Dovesi, R.

Use of ab initio methods for the interpretation of the experimental IR reflectance spectra of crystalline compounds

JOURNAL OF COMPUTATIONAL CHEMISTRY

IF4.8

2013-04-04

OAAI

De la Pierre, Marco; Carteret, Cedric; Orlando, Roberto; Dovesi, Roberto

The vibration properties of the (n,0) boron nitride nanotubes from ab initio quantum chemical simulations

JOURNAL OF CHEMICAL PHYSICS

IF3.1

2013-02-07

OAAI

Erba, A.; Ferrabone, M.; Baima, J.; Orlando, R.; Rerat, M.; Dovesi, R.

Ab Initio Periodic Simulation of the Spectroscopic and Optical Properties of Novel Porous Graphene Phases

JOURNAL OF PHYSICAL CHEMISTRY C

IF3.2

2013-01-23

OAAI

De La Pierre, Marco; Karamanis, Panaghiotis; Baima, Jacopo; Orlando, Roberto; Pouchan, Claude; Dovesi, Roberto

Ab initio analytical infrared intensities for periodic systems through a coupled perturbed Hartree-Fock/Kohn-Sham method

JOURNAL OF CHEMICAL PHYSICS

IF3.1

2012-11-27

150

PREAI

Maschio, Lorenzo; Kirtman, Bernard; Orlando, Roberto; Rerat, Michel

Accurate dynamical structure factors from ab initio lattice dynamics: The case of crystalline silicon

JOURNAL OF COMPUTATIONAL CHEMISTRY

IF4.8

2012-10-18

OAAI

Erba, Alessandro; Ferrabone, Matteo; Orlando, Roberto; Dovesi, Roberto

Stability Model of Silicon Nanowire Polymorphs and First-Principle Conductivity of Bulk Silicon

JOURNAL OF PHYSICAL CHEMISTRY C

IF3.2

2012-10-03

PREAI

Garcia-Castello, Nuria; Prades, J. Daniel; Orlando, Roberto; Cirera, Albert

研究方向