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physical sciences (67) 67
science & technology (65) 65
chemistry (62) 62
chemistry, multidisciplinary (47) 47
crystallography (37) 37
crystals (17) 17
physics (15) 15
structure (14) 14
computer simulation (12) 12
materials science (11) 11
molecular dynamics (11) 11
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crystal structure (8) 8
exact sciences and technology (8) 8
organic crystals (8) 8
settore chim/02 - chimica fisica (8) 8
condensed matter: structure, mechanical and thermal properties (7) 7
intermolecular forces (7) 7
liquids (7) 7
structure of solids and liquids; crystallography (7) 7
analysis (6) 6
quantum chemistry (6) 6
thermodynamics (6) 6
crystallization (5) 5
kristallstruktur (5) 5
mineralogy (5) 5
organic compounds (5) 5
physics, atomic, molecular & chemical (5) 5
structure of specific crystalline solids (5) 5
chemistry, organic (4) 4
hydrogen bonding (4) 4
mathematical analysis (4) 4
molecular recognition (4) 4
pixel calculations (4) 4
polymorphism (4) 4
settore chim/03 - chimica generale e inorganica (4) 4
chemical bonds (3) 3
chemische bindung (3) 3
chemistry, physical and theoretical (3) 3
crystal engineering (3) 3
crystal structure prediction (3) 3
crystallography, x-ray (3) 3
diffraction (3) 3
distribution functions (3) 3
enthalpy (3) 3
intermolecular interactions (3) 3
leptology (3) 3
models, molecular (3) 3
molecular conformation (3) 3
molecular crystals (3) 3
monte-carlo-simulation (3) 3
research (3) 3
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simulation (3) 3
solids (3) 3
structure prediction (3) 3
sublimation (3) 3
x-ray diffraction (3) 3
algorithms (2) 2
arsenic (2) 2
atomic, molecular, and optical physics (2) 2
chemical structure (2) 2
computer programs (2) 2
condensed phases (2) 2
cristais moleculares (2) 2
cristales (2) 2
cristalografía (2) 2
crystal growth (2) 2
crystal-structure (2) 2
crystalline state (2) 2
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elektrostatisches potential (2) 2
energy use (2) 2
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halogens (2) 2
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hydrogen (2) 2
hydrogen bonds (2) 2
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life sciences & biomedicine (2) 2
mathematisches modell (2) 2
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models, chemical (2) 2
molecular aggregation (2) 2
molecular dimers (2) 2
molecular modelling (2) 2
molecular structure (2) 2
molecules (2) 2
molekulardynamik (2) 2
molekulare erkennung (2) 2
multi-user (2) 2
nitrogen (2) 2
nucleation (2) 2
organic chemicals - chemistry (2) 2
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CrystEngComm, ISSN 1466-8033, 4/2013, Volume 15, Issue 2, pp. 427 - 435
Journal Article
CrystEngComm, ISSN 1466-8033, 2008, Volume 10, Issue 4, pp. 389 - 398
Journal Article
20.